iterations/neb0_image06_iter37_OSZICAR.out output for 745: 733-->741: H2O near HO-Si on SiO2 surface --> H-OSi + OH-Si on SiO2 surface (TSS)
Status: runningN E dE d eps ncg rms rms(c) DAV: 1 0.424075240143E+04 0.42408E+04 -0.23863E+05 2892 0.117E+03 DAV: 2 -0.427962780381E+03 -0.46687E+04 -0.45726E+04 3369 0.329E+02 DAV: 3 -0.942359339689E+03 -0.51440E+03 -0.51215E+03 3120 0.118E+02 DAV: 4 -0.954632470203E+03 -0.12273E+02 -0.12227E+02 3183 0.196E+01 DAV: 5 -0.955035419037E+03 -0.40295E+00 -0.40241E+00 3192 0.321E+00 0.812E+01 DAV: 6 -0.846909965791E+03 0.10813E+03 -0.47027E+02 3057 0.347E+01 0.375E+01 DAV: 7 -0.846439358654E+03 0.47061E+00 -0.14693E+01 3543 0.608E+00 0.146E+01 DAV: 8 -0.846077247151E+03 0.36211E+00 -0.97824E-01 3147 0.237E+00 0.596E+00 DAV: 9 -0.846000803166E+03 0.76444E-01 -0.43194E-01 3183 0.150E+00 0.871E-01 DAV: 10 -0.845995254903E+03 0.55483E-02 -0.72008E-02 3120 0.596E-01 0.578E-01 DAV: 11 -0.845988678743E+03 0.65762E-02 -0.67120E-03 3138 0.228E-01 0.325E-01 DAV: 12 -0.845982175536E+03 0.65032E-02 -0.82268E-03 3129 0.290E-01 0.129E-01 DAV: 13 -0.845981697202E+03 0.47833E-03 -0.55378E-03 3093 0.250E-01 0.152E-01 DAV: 14 -0.845984698988E+03 -0.30018E-02 -0.36320E-03 3075 0.162E-01 0.108E-01 DAV: 15 -0.845990122032E+03 -0.54230E-02 -0.15740E-03 3129 0.126E-01 0.445E-02 DAV: 16 -0.845992587580E+03 -0.24655E-02 -0.62948E-04 3093 0.612E-02 0.406E-02 DAV: 17 -0.845993610636E+03 -0.10231E-02 -0.18216E-04 3129 0.290E-02 0.250E-02 DAV: 18 -0.845994647492E+03 -0.10369E-02 -0.38837E-05 2625 0.166E-02 0.109E-02 DAV: 19 -0.845995416981E+03 -0.76949E-03 -0.39138E-05 2661 0.197E-02 0.897E-03 DAV: 20 -0.845995537611E+03 -0.12063E-03 -0.29043E-05 2634 0.129E-02 0.728E-03 DAV: 21 -0.845995584748E+03 -0.47137E-04 -0.34875E-06 1977 0.537E-03 0.468E-03 DAV: 22 -0.845995654243E+03 -0.69496E-04 -0.54543E-06 1950 0.607E-03 0.245E-03 DAV: 23 -0.845995671122E+03 -0.16879E-04 -0.30811E-06 1995 0.457E-03 0.274E-03 DAV: 24 -0.845995673163E+03 -0.20413E-05 -0.12736E-06 2031 0.299E-03 1 F= -.84599567E+03 E0= -.84599964E+03 d E =0.119033E-01