./iterations/neb0_image09_iter67_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 0.423645806437E+04 0.42365E+04 -0.23863E+05 2892 0.117E+03 DAV: 2 -0.427791521389E+03 -0.46642E+04 -0.45642E+04 3366 0.329E+02 DAV: 3 -0.942938722840E+03 -0.51515E+03 -0.51298E+03 3120 0.118E+02 DAV: 4 -0.955234036717E+03 -0.12295E+02 -0.12250E+02 3183 0.196E+01 DAV: 5 -0.955637890362E+03 -0.40385E+00 -0.40331E+00 3174 0.321E+00 0.812E+01 DAV: 6 -0.847634726310E+03 0.10800E+03 -0.47147E+02 3057 0.348E+01 0.376E+01 DAV: 7 -0.847082499829E+03 0.55223E+00 -0.14669E+01 3507 0.623E+00 0.147E+01 DAV: 8 -0.846737831322E+03 0.34467E+00 -0.16961E+00 3246 0.355E+00 0.608E+00 DAV: 9 -0.846649138388E+03 0.88693E-01 -0.68368E-01 3201 0.201E+00 0.151E+00 DAV: 10 -0.846641353451E+03 0.77849E-02 -0.17987E-01 3534 0.128E+00 0.139E+00 DAV: 11 -0.846599786418E+03 0.41567E-01 -0.59142E-02 3489 0.873E-01 0.842E-01 DAV: 12 -0.846592340960E+03 0.74455E-02 -0.75399E-02 3408 0.609E-01 0.607E-01 DAV: 13 -0.846584594325E+03 0.77466E-02 -0.22630E-02 3120 0.435E-01 0.332E-01 DAV: 14 -0.846584531788E+03 0.62536E-04 -0.19037E-02 3201 0.305E-01 0.407E-01 DAV: 15 -0.846586463090E+03 -0.19313E-02 -0.64477E-02 3543 0.551E-01 0.660E-01 DAV: 16 -0.846580642668E+03 0.58204E-02 -0.10633E-02 3030 0.224E-01 0.317E-01 DAV: 17 -0.846581167557E+03 -0.52489E-03 -0.68752E-03 3066 0.176E-01 0.127E-01 DAV: 18 -0.846583751799E+03 -0.25842E-02 -0.24411E-03 3030 0.157E-01 0.109E-01 DAV: 19 -0.846586446441E+03 -0.26946E-02 -0.17343E-03 3093 0.122E-01 0.820E-02 DAV: 20 -0.846589095000E+03 -0.26486E-02 -0.85521E-04 3084 0.657E-02 0.703E-02 DAV: 21 -0.846590972855E+03 -0.18779E-02 -0.45974E-04 3147 0.555E-02 0.402E-02 DAV: 22 -0.846592425438E+03 -0.14526E-02 -0.27620E-04 3084 0.385E-02 0.443E-02 DAV: 23 -0.846593140731E+03 -0.71529E-03 -0.11349E-04 2859 0.265E-02 0.189E-02 DAV: 24 -0.846593681896E+03 -0.54116E-03 -0.55858E-05 2625 0.207E-02 0.127E-02 DAV: 25 -0.846593969268E+03 -0.28737E-03 -0.25835E-05 2076 0.150E-02 0.106E-02 DAV: 26 -0.846594111886E+03 -0.14262E-03 -0.12811E-05 1968 0.882E-03 0.400E-03 DAV: 27 -0.846594172129E+03 -0.60243E-04 -0.54233E-06 1986 0.591E-03 0.275E-03 DAV: 28 -0.846594204918E+03 -0.32789E-04 -0.31226E-06 1950 0.442E-03 0.233E-03 DAV: 29 -0.846594215296E+03 -0.10378E-04 -0.16915E-06 2004 0.331E-03 0.146E-03 DAV: 30 -0.846594217713E+03 -0.24168E-05 -0.82287E-07 2004 0.187E-03 1 F= -.84659422E+03 E0= -.84664439E+03 d E =0.150529E+00