iterations/neb0_image08_iter63_OSZICAR.out output for 745: 733-->741: H2O near HO-Si on SiO2 surface --> H-OSi + OH-Si on SiO2 surface (TSS)

Status: running

       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1     0.423695307613E+04    0.42370E+04   -0.23864E+05  2892   0.117E+03 
DAV:   2    -0.428355926981E+03   -0.46653E+04   -0.45662E+04  3369   0.329E+02 
DAV:   3    -0.942938729311E+03   -0.51458E+03   -0.51240E+03  3120   0.118E+02 
DAV:   4    -0.955189325578E+03   -0.12251E+02   -0.12205E+02  3183   0.196E+01 
DAV:   5    -0.955592005400E+03   -0.40268E+00   -0.40214E+00  3201   0.321E+00    0.813E+01
DAV:   6    -0.847615257636E+03    0.10798E+03   -0.47139E+02  3093   0.348E+01    0.376E+01
DAV:   7    -0.846970087119E+03    0.64517E+00   -0.14851E+01  3516   0.647E+00    0.148E+01
DAV:   8    -0.846678231564E+03    0.29186E+00   -0.21720E+00  3174   0.364E+00    0.606E+00
DAV:   9    -0.846573608545E+03    0.10462E+00   -0.79251E-01  3309   0.212E+00    0.159E+00
DAV:  10    -0.846530211100E+03    0.43397E-01   -0.17370E-01  3525   0.125E+00    0.137E+00
DAV:  11    -0.846514852789E+03    0.15358E-01   -0.82643E-02  3570   0.966E-01    0.113E+00
DAV:  12    -0.846503249996E+03    0.11603E-01   -0.97084E-02  3615   0.580E-01    0.740E-01
DAV:  13    -0.846498254099E+03    0.49959E-02   -0.61091E-02  3363   0.688E-01    0.771E-01
DAV:  14    -0.846490744773E+03    0.75093E-02   -0.32674E-02  3417   0.383E-01    0.389E-01
DAV:  15    -0.846490720597E+03    0.24176E-04   -0.31975E-02  3318   0.411E-01    0.515E-01
DAV:  16    -0.846486940682E+03    0.37799E-02   -0.11436E-02  3156   0.214E-01    0.188E-01
DAV:  17    -0.846487975070E+03   -0.10344E-02   -0.44472E-03  3012   0.173E-01    0.158E-01
DAV:  18    -0.846489346523E+03   -0.13715E-02   -0.26755E-03  3264   0.114E-01    0.150E-01
DAV:  19    -0.846492734812E+03   -0.33883E-02   -0.28425E-03  3156   0.127E-01    0.124E-01
DAV:  20    -0.846495292920E+03   -0.25581E-02   -0.11618E-03  3129   0.783E-02    0.677E-02
DAV:  21    -0.846497845632E+03   -0.25527E-02   -0.92914E-04  3084   0.668E-02    0.839E-02
DAV:  22    -0.846499223012E+03   -0.13774E-02   -0.28330E-04  3111   0.460E-02    0.458E-02
DAV:  23    -0.846499754827E+03   -0.53182E-03   -0.14588E-04  3102   0.276E-02    0.293E-02
DAV:  24    -0.846500234110E+03   -0.47928E-03   -0.96774E-05  2922   0.287E-02    0.212E-02
DAV:  25    -0.846500583977E+03   -0.34987E-03   -0.41191E-05  2418   0.146E-02    0.107E-02
DAV:  26    -0.846500728200E+03   -0.14422E-03   -0.10427E-05  1977   0.898E-03    0.685E-03
DAV:  27    -0.846500830130E+03   -0.10193E-03   -0.70890E-06  1968   0.806E-03    0.507E-03
DAV:  28    -0.846500872254E+03   -0.42123E-04   -0.65925E-06  1986   0.589E-03    0.354E-03
DAV:  29    -0.846500881994E+03   -0.97400E-05   -0.19539E-06  2004   0.327E-03 
   1 F= -.84650088E+03 E0= -.84655077E+03  d E =0.149670E+00