./iterations/neb0_image02_iter35_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 0.423266769734E+04 0.42327E+04 -0.23865E+05 2892 0.117E+03 DAV: 2 -0.430472265437E+03 -0.46631E+04 -0.45622E+04 3366 0.329E+02 DAV: 3 -0.943307266679E+03 -0.51284E+03 -0.51063E+03 3120 0.117E+02 DAV: 4 -0.955513327637E+03 -0.12206E+02 -0.12161E+02 3183 0.195E+01 DAV: 5 -0.955914647652E+03 -0.40132E+00 -0.40079E+00 3201 0.320E+00 0.813E+01 DAV: 6 -0.847844281694E+03 0.10807E+03 -0.47090E+02 3066 0.347E+01 0.376E+01 DAV: 7 -0.847378932099E+03 0.46535E+00 -0.14405E+01 3543 0.607E+00 0.146E+01 DAV: 8 -0.847042661194E+03 0.33627E+00 -0.96191E-01 3165 0.237E+00 0.593E+00 DAV: 9 -0.846996218865E+03 0.46442E-01 -0.41236E-01 3192 0.153E+00 0.858E-01 DAV: 10 -0.847003196666E+03 -0.69778E-02 -0.73095E-02 3111 0.607E-01 0.599E-01 DAV: 11 -0.847003206822E+03 -0.10156E-04 -0.66639E-03 3111 0.207E-01 0.341E-01 DAV: 12 -0.847004623748E+03 -0.14169E-02 -0.69642E-03 3066 0.244E-01 0.118E-01 DAV: 13 -0.847008101675E+03 -0.34779E-02 -0.45744E-03 3219 0.216E-01 0.135E-01 DAV: 14 -0.847012241775E+03 -0.41401E-02 -0.29778E-03 3093 0.143E-01 0.944E-02 DAV: 15 -0.847017016838E+03 -0.47751E-02 -0.12123E-03 3129 0.846E-02 0.365E-02 DAV: 16 -0.847019332695E+03 -0.23159E-02 -0.40116E-04 3111 0.485E-02 0.381E-02 DAV: 17 -0.847020379623E+03 -0.10469E-02 -0.24431E-04 3111 0.375E-02 0.266E-02 DAV: 18 -0.847021071632E+03 -0.69201E-03 -0.33254E-05 2517 0.203E-02 0.138E-02 DAV: 19 -0.847021660108E+03 -0.58848E-03 -0.40861E-05 2706 0.218E-02 0.725E-03 DAV: 20 -0.847021763401E+03 -0.10329E-03 -0.31340E-05 2688 0.141E-02 0.653E-03 DAV: 21 -0.847021801951E+03 -0.38550E-04 -0.31001E-06 1995 0.418E-03 0.570E-03 DAV: 22 -0.847021824010E+03 -0.22059E-04 -0.20719E-06 1995 0.331E-03 0.260E-03 DAV: 23 -0.847021834135E+03 -0.10126E-04 -0.15560E-06 1986 0.316E-03 0.117E-03 DAV: 24 -0.847021836973E+03 -0.28374E-05 -0.67463E-07 1995 0.180E-03 1 F= -.84702184E+03 E0= -.84702570E+03 d E =0.115958E-01