./iterations/neb0_image09_iter42_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     0.423673555630E+04    0.42367E+04   -0.23863E+05  2892   0.117E+03 
DAV:   2    -0.427753796426E+03   -0.46645E+04   -0.45645E+04  3366   0.329E+02 
DAV:   3    -0.942931857368E+03   -0.51518E+03   -0.51301E+03  3120   0.118E+02 
DAV:   4    -0.955231245330E+03   -0.12299E+02   -0.12254E+02  3183   0.196E+01 
DAV:   5    -0.955635506859E+03   -0.40426E+00   -0.40373E+00  3192   0.321E+00    0.813E+01
DAV:   6    -0.847628365738E+03    0.10801E+03   -0.47148E+02  3048   0.348E+01    0.376E+01
DAV:   7    -0.847070827451E+03    0.55754E+00   -0.14645E+01  3516   0.623E+00    0.148E+01
DAV:   8    -0.846728074710E+03    0.34275E+00   -0.17454E+00  3246   0.357E+00    0.608E+00
DAV:   9    -0.846645632234E+03    0.82442E-01   -0.69888E-01  3228   0.205E+00    0.156E+00
DAV:  10    -0.846630782326E+03    0.14850E-01   -0.16575E-01  3534   0.124E+00    0.125E+00
DAV:  11    -0.846595291262E+03    0.35491E-01   -0.53635E-02  3471   0.796E-01    0.799E-01
DAV:  12    -0.846598992473E+03   -0.37012E-02   -0.19322E-01  4128   0.106E+00    0.132E+00
DAV:  13    -0.846577187799E+03    0.21805E-01   -0.12172E-01  3570   0.690E-01    0.501E-01
DAV:  14    -0.846573135802E+03    0.40520E-02   -0.23666E-02  3066   0.354E-01    0.296E-01
DAV:  15    -0.846571218799E+03    0.19170E-02   -0.12580E-02  3138   0.361E-01    0.304E-01
DAV:  16    -0.846571011370E+03    0.20743E-03   -0.60572E-03  3012   0.227E-01    0.329E-01
DAV:  17    -0.846571255351E+03   -0.24398E-03   -0.57400E-03  3444   0.199E-01    0.141E-01
DAV:  18    -0.846572925141E+03   -0.16698E-02   -0.27336E-03  3057   0.126E-01    0.104E-01
DAV:  19    -0.846575511249E+03   -0.25861E-02   -0.12726E-03  3075   0.858E-02    0.705E-02
DAV:  20    -0.846579027532E+03   -0.35163E-02   -0.10300E-03  3102   0.971E-02    0.828E-02
DAV:  21    -0.846580872773E+03   -0.18452E-02   -0.10092E-03  3093   0.713E-02    0.385E-02
DAV:  22    -0.846582006137E+03   -0.11334E-02   -0.22004E-04  3093   0.307E-02    0.308E-02
DAV:  23    -0.846582595105E+03   -0.58897E-03   -0.77014E-05  2940   0.198E-02    0.151E-02
DAV:  24    -0.846583121990E+03   -0.52688E-03   -0.32908E-05  2346   0.193E-02    0.121E-02
DAV:  25    -0.846583396056E+03   -0.27407E-03   -0.24680E-05  1995   0.163E-02    0.983E-03
DAV:  26    -0.846583495907E+03   -0.99850E-04   -0.10657E-05  1968   0.713E-03    0.535E-03
DAV:  27    -0.846583565413E+03   -0.69507E-04   -0.51145E-06  1968   0.543E-03    0.304E-03
DAV:  28    -0.846583592939E+03   -0.27526E-04   -0.27679E-06  1977   0.483E-03    0.240E-03
DAV:  29    -0.846583600264E+03   -0.73257E-05   -0.21989E-06  2004   0.395E-03 
   1 F= -.84658360E+03 E0= -.84663353E+03  d E =0.149783E+00