./iterations/neb0_image03_iter2_OSZICAR.out output for 41: 3.3A-->1.3A (Job 121) O-H...N hydrogen bond by TSA-OH, TSA-NH2 (TSS)

Status: finished

       N       E                     dE             d eps       ncg     rms          rms(c)
DAV:   1     0.403639589860E+03    0.40364E+03   -0.15915E+04   424   0.706E+02 
DAV:   2    -0.130471810116E+02   -0.41669E+03   -0.39809E+03   593   0.166E+02 
DAV:   3    -0.140158083368E+03   -0.12711E+03   -0.12644E+03   528   0.972E+01 
DAV:   4    -0.148973901218E+03   -0.88158E+01   -0.87966E+01   464   0.314E+01 
DAV:   5    -0.149217464456E+03   -0.24356E+00   -0.24345E+00   528   0.478E+00    0.248E+01
DAV:   6    -0.136802584849E+03    0.12415E+02   -0.37741E+01   450   0.257E+01    0.131E+01
DAV:   7    -0.135356118611E+03    0.14465E+01   -0.47228E+00   496   0.881E+00    0.601E+00
DAV:   8    -0.134727586667E+03    0.62853E+00   -0.91464E-01   488   0.436E+00    0.210E+00
DAV:   9    -0.134572885696E+03    0.15470E+00   -0.29366E-01   480   0.217E+00    0.599E-01
DAV:  10    -0.134553348946E+03    0.19537E-01   -0.50939E-02   480   0.962E-01    0.399E-01
DAV:  11    -0.134544836302E+03    0.85126E-02   -0.91375E-03   464   0.437E-01    0.176E-01
DAV:  12    -0.134539740159E+03    0.50961E-02   -0.86649E-03   464   0.316E-01    0.126E-01
DAV:  13    -0.134543610360E+03   -0.38702E-02   -0.44126E-03   465   0.281E-01    0.970E-02
DAV:  14    -0.134549990249E+03   -0.63799E-02   -0.22085E-03   456   0.190E-01    0.611E-02
DAV:  15    -0.134555403212E+03   -0.54130E-02   -0.16617E-03   528   0.155E-01    0.488E-02
DAV:  16    -0.134558915791E+03   -0.35126E-02   -0.35520E-04   456   0.753E-02    0.375E-02
DAV:  17    -0.134561981209E+03   -0.30654E-02   -0.45093E-04   528   0.705E-02    0.126E-02
DAV:  18    -0.134563302344E+03   -0.13211E-02   -0.11644E-04   488   0.377E-02    0.164E-02
DAV:  19    -0.134564131480E+03   -0.82914E-03   -0.62901E-05   496   0.287E-02    0.507E-03
DAV:  20    -0.134564434929E+03   -0.30345E-03   -0.24917E-05   400   0.183E-02    0.706E-03
DAV:  21    -0.134564537801E+03   -0.10287E-03   -0.59331E-06   344   0.109E-02    0.407E-03
DAV:  22    -0.134564570797E+03   -0.32996E-04   -0.33516E-06   336   0.678E-03    0.214E-03
DAV:  23    -0.134564610078E+03   -0.39281E-04   -0.26269E-06   328   0.679E-03    0.846E-04
DAV:  24    -0.134564626610E+03   -0.16532E-04   -0.20735E-06   336   0.432E-03    0.144E-03
DAV:  25    -0.134564628604E+03   -0.19933E-05   -0.42566E-07   360   0.246E-03 
   1 F= -.13456463E+03 E0= -.13457023E+03  d E =0.168180E-01