./iterations/neb0_image07_iter263_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 0.371659169000E+03 0.37166E+03 -0.14323E+04 632 0.799E+02
DAV: 2 0.371769448265E+01 -0.36794E+03 -0.35634E+03 869 0.194E+02
DAV: 3 -0.966870196167E+02 -0.10040E+03 -0.10009E+03 696 0.116E+02
DAV: 4 -0.101193803830E+03 -0.45068E+01 -0.44956E+01 712 0.280E+01
DAV: 5 -0.101281924498E+03 -0.88121E-01 -0.88078E-01 728 0.353E+00 0.227E+01
DAV: 6 -0.926235620400E+02 0.86584E+01 -0.30963E+01 701 0.300E+01 0.119E+01
DAV: 7 -0.917669912599E+02 0.85657E+00 -0.17216E+00 736 0.615E+00 0.480E+00
DAV: 8 -0.913909043540E+02 0.37609E+00 -0.54056E-01 736 0.396E+00 0.162E+00
DAV: 9 -0.913083372272E+02 0.82567E-01 -0.12904E-01 720 0.154E+00 0.420E-01
DAV: 10 -0.912991843961E+02 0.91528E-02 -0.43484E-02 749 0.106E+00 0.298E-01
DAV: 11 -0.913039143940E+02 -0.47300E-02 -0.13664E-02 608 0.602E-01 0.156E-01
DAV: 12 -0.913068184146E+02 -0.29040E-02 -0.28066E-03 620 0.253E-01 0.972E-02
DAV: 13 -0.913105623101E+02 -0.37439E-02 -0.17678E-03 644 0.208E-01 0.495E-02
DAV: 14 -0.913141742153E+02 -0.36119E-02 -0.10473E-03 714 0.221E-01 0.459E-02
DAV: 15 -0.913154167900E+02 -0.12426E-02 -0.33598E-04 680 0.106E-01 0.325E-02
DAV: 16 -0.913161231466E+02 -0.70636E-03 -0.16340E-04 741 0.808E-02 0.111E-02
DAV: 17 -0.913170133547E+02 -0.89021E-03 -0.11090E-04 676 0.514E-02 0.144E-02
DAV: 18 -0.913172181621E+02 -0.20481E-03 -0.10694E-05 496 0.173E-02 0.109E-02
DAV: 19 -0.913173909918E+02 -0.17283E-03 -0.46704E-05 601 0.389E-02 0.509E-03
DAV: 20 -0.913174077745E+02 -0.16783E-04 -0.41419E-06 520 0.141E-02 0.381E-03
DAV: 21 -0.913174219333E+02 -0.14159E-04 -0.22030E-06 412 0.808E-03 0.170E-03
DAV: 22 -0.913174381670E+02 -0.16234E-04 -0.20545E-06 431 0.633E-03 0.540E-04
DAV: 23 -0.913174399387E+02 -0.17717E-05 -0.71075E-07 512 0.416E-03
1 F= -.91317440E+02 E0= -.91322096E+02 d E =0.139686E-01