./iterations/neb0_image03_iter265_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 0.363420868615E+03 0.36342E+03 -0.14326E+04 632 0.799E+02
DAV: 2 0.141984305953E+01 -0.36200E+03 -0.35063E+03 845 0.195E+02
DAV: 3 -0.959391988405E+02 -0.97359E+02 -0.97048E+02 661 0.116E+02
DAV: 4 -0.100331081194E+03 -0.43919E+01 -0.43818E+01 712 0.283E+01
DAV: 5 -0.100417748902E+03 -0.86668E-01 -0.86641E-01 744 0.356E+00 0.223E+01
DAV: 6 -0.917269227082E+02 0.86908E+01 -0.31362E+01 688 0.300E+01 0.117E+01
DAV: 7 -0.908821558320E+02 0.84477E+00 -0.18001E+00 712 0.635E+00 0.485E+00
DAV: 8 -0.904892318230E+02 0.39292E+00 -0.56045E-01 696 0.431E+00 0.170E+00
DAV: 9 -0.903981638122E+02 0.91068E-01 -0.13692E-01 704 0.168E+00 0.441E-01
DAV: 10 -0.903919738674E+02 0.61899E-02 -0.47515E-02 712 0.125E+00 0.335E-01
DAV: 11 -0.903956799355E+02 -0.37061E-02 -0.67501E-03 624 0.579E-01 0.131E-01
DAV: 12 -0.903993640720E+02 -0.36841E-02 -0.65110E-03 621 0.392E-01 0.125E-01
DAV: 13 -0.904033762704E+02 -0.40122E-02 -0.15978E-03 864 0.305E-01 0.854E-02
DAV: 14 -0.904065150570E+02 -0.31388E-02 -0.11858E-03 645 0.154E-01 0.574E-02
DAV: 15 -0.904088726555E+02 -0.23576E-02 -0.45760E-04 685 0.117E-01 0.320E-02
DAV: 16 -0.904101236691E+02 -0.12510E-02 -0.34844E-04 672 0.962E-02 0.260E-02
DAV: 17 -0.904109327358E+02 -0.80907E-03 -0.15521E-04 708 0.756E-02 0.109E-02
DAV: 18 -0.904111811725E+02 -0.24844E-03 -0.45995E-05 624 0.351E-02 0.109E-02
DAV: 19 -0.904112822454E+02 -0.10107E-03 -0.12203E-05 472 0.231E-02 0.479E-03
DAV: 20 -0.904113546762E+02 -0.72431E-04 -0.20254E-05 506 0.235E-02 0.533E-03
DAV: 21 -0.904113921848E+02 -0.37509E-04 -0.59829E-06 469 0.157E-02 0.210E-03
DAV: 22 -0.904113960914E+02 -0.39066E-05 -0.21540E-06 544 0.697E-03
1 F= -.90411396E+02 E0= -.90419189E+02 d E =0.233797E-01