./iterations/neb0_image04_iter27_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 0.423247437614E+04 0.42325E+04 -0.23860E+05 2892 0.117E+03 DAV: 2 -0.428703774582E+03 -0.46612E+04 -0.45665E+04 3360 0.329E+02 DAV: 3 -0.942022060916E+03 -0.51332E+03 -0.51105E+03 3120 0.117E+02 DAV: 4 -0.954319278284E+03 -0.12297E+02 -0.12250E+02 3192 0.196E+01 DAV: 5 -0.954723690915E+03 -0.40441E+00 -0.40384E+00 3192 0.321E+00 0.811E+01 DAV: 6 -0.846630025326E+03 0.10809E+03 -0.47076E+02 3057 0.347E+01 0.376E+01 DAV: 7 -0.846172496884E+03 0.45753E+00 -0.14338E+01 3534 0.609E+00 0.146E+01 DAV: 8 -0.845845410548E+03 0.32709E+00 -0.96683E-01 3165 0.238E+00 0.596E+00 DAV: 9 -0.845804217305E+03 0.41193E-01 -0.41563E-01 3183 0.153E+00 0.859E-01 DAV: 10 -0.845810315008E+03 -0.60977E-02 -0.71633E-02 3129 0.600E-01 0.609E-01 DAV: 11 -0.845809659348E+03 0.65566E-03 -0.65153E-03 3111 0.211E-01 0.347E-01 DAV: 12 -0.845809873244E+03 -0.21390E-03 -0.67155E-03 3102 0.248E-01 0.117E-01 DAV: 13 -0.845812465344E+03 -0.25921E-02 -0.43825E-03 3147 0.218E-01 0.134E-01 DAV: 14 -0.845816234738E+03 -0.37694E-02 -0.30711E-03 3111 0.147E-01 0.935E-02 DAV: 15 -0.845820792491E+03 -0.45578E-02 -0.13413E-03 3066 0.955E-02 0.418E-02 DAV: 16 -0.845822923188E+03 -0.21307E-02 -0.38283E-04 3138 0.517E-02 0.381E-02 DAV: 17 -0.845823966294E+03 -0.10431E-02 -0.27813E-04 3120 0.396E-02 0.275E-02 DAV: 18 -0.845824679316E+03 -0.71302E-03 -0.36167E-05 2643 0.206E-02 0.139E-02 DAV: 19 -0.845825261501E+03 -0.58219E-03 -0.38082E-05 2661 0.217E-02 0.710E-03 DAV: 20 -0.845825360396E+03 -0.98894E-04 -0.32248E-05 2742 0.139E-02 0.677E-03 DAV: 21 -0.845825404254E+03 -0.43859E-04 -0.29821E-06 1995 0.407E-03 0.566E-03 DAV: 22 -0.845825432743E+03 -0.28489E-04 -0.26789E-06 1959 0.357E-03 0.227E-03 DAV: 23 -0.845825444543E+03 -0.11800E-04 -0.14153E-06 1986 0.312E-03 0.122E-03 DAV: 24 -0.845825446895E+03 -0.23523E-05 -0.65876E-07 2004 0.185E-03 1 F= -.84582545E+03 E0= -.84582931E+03 d E =0.115959E-01