./iterations/neb0_image06_iter52_OSZICAR.out output for 44: 750-->752: Si-OH + Si-H , to Si-O-SI + H2 (TSS)
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.375433755181E+03 0.37543E+03 -0.14310E+04 632 0.799E+02
DAV: 2 0.473020440051E+01 -0.37070E+03 -0.35746E+03 861 0.195E+02
DAV: 3 -0.955637287193E+02 -0.10029E+03 -0.99966E+02 672 0.117E+02
DAV: 4 -0.999913138079E+02 -0.44276E+01 -0.44168E+01 704 0.283E+01
DAV: 5 -0.100081847298E+03 -0.90533E-01 -0.90498E-01 728 0.358E+00 0.226E+01
DAV: 6 -0.914875746478E+02 0.85943E+01 -0.30679E+01 677 0.305E+01 0.117E+01
DAV: 7 -0.906555236675E+02 0.83205E+00 -0.17040E+00 728 0.624E+00 0.480E+00
DAV: 8 -0.902754034520E+02 0.38012E+00 -0.52792E-01 704 0.408E+00 0.165E+00
DAV: 9 -0.901852467687E+02 0.90157E-01 -0.12520E-01 720 0.161E+00 0.427E-01
DAV: 10 -0.901756791838E+02 0.95676E-02 -0.40341E-02 717 0.100E+00 0.314E-01
DAV: 11 -0.901807274186E+02 -0.50482E-02 -0.16945E-02 674 0.930E-01 0.218E-01
DAV: 12 -0.901810367205E+02 -0.30930E-03 -0.47259E-03 668 0.399E-01 0.154E-01
DAV: 13 -0.901849545456E+02 -0.39178E-02 -0.44589E-03 627 0.425E-01 0.109E-01
DAV: 14 -0.901875724440E+02 -0.26179E-02 -0.11887E-03 672 0.177E-01 0.813E-02
DAV: 15 -0.901901039880E+02 -0.25315E-02 -0.77098E-04 741 0.185E-01 0.364E-02
DAV: 16 -0.901923183701E+02 -0.22144E-02 -0.51172E-04 672 0.122E-01 0.312E-02
DAV: 17 -0.901930484614E+02 -0.73009E-03 -0.66149E-05 712 0.530E-02 0.214E-02
DAV: 18 -0.901937136209E+02 -0.66516E-03 -0.11990E-04 647 0.554E-02 0.775E-03
DAV: 19 -0.901938647516E+02 -0.15113E-03 -0.11330E-05 512 0.213E-02 0.618E-03
DAV: 20 -0.901939646620E+02 -0.99910E-04 -0.12451E-05 428 0.174E-02 0.318E-03
DAV: 21 -0.901940014476E+02 -0.36786E-04 -0.39116E-06 504 0.124E-02 0.246E-03
DAV: 22 -0.901940195912E+02 -0.18144E-04 -0.38963E-06 406 0.985E-03 0.286E-03
DAV: 23 -0.901940231428E+02 -0.35516E-05 -0.12882E-06 504 0.861E-03
1 F= -.90194023E+02 E0= -.90204106E+02 d E =0.302496E-01