./iterations/neb0_image03_iter22_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     0.403795718607E+03    0.40380E+03   -0.15916E+04   424   0.706E+02 
DAV:   2    -0.133322576133E+02   -0.41713E+03   -0.39826E+03   601   0.166E+02 
DAV:   3    -0.140257318188E+03   -0.12693E+03   -0.12627E+03   528   0.973E+01 
DAV:   4    -0.148987795134E+03   -0.87305E+01   -0.87113E+01   464   0.313E+01 
DAV:   5    -0.149228716108E+03   -0.24092E+00   -0.24081E+00   528   0.476E+00    0.248E+01
DAV:   6    -0.136809706328E+03    0.12419E+02   -0.37704E+01   450   0.257E+01    0.131E+01
DAV:   7    -0.135358286209E+03    0.14514E+01   -0.47204E+00   496   0.882E+00    0.601E+00
DAV:   8    -0.134729034619E+03    0.62925E+00   -0.91773E-01   488   0.436E+00    0.210E+00
DAV:   9    -0.134574549286E+03    0.15449E+00   -0.29363E-01   480   0.217E+00    0.599E-01
DAV:  10    -0.134554979782E+03    0.19570E-01   -0.50135E-02   480   0.953E-01    0.399E-01
DAV:  11    -0.134546325236E+03    0.86545E-02   -0.92687E-03   464   0.437E-01    0.176E-01
DAV:  12    -0.134541132263E+03    0.51930E-02   -0.85406E-03   472   0.315E-01    0.127E-01
DAV:  13    -0.134545274787E+03   -0.41425E-02   -0.49854E-03   473   0.297E-01    0.992E-02
DAV:  14    -0.134551245385E+03   -0.59706E-02   -0.20563E-03   456   0.188E-01    0.631E-02
DAV:  15    -0.134556726391E+03   -0.54810E-02   -0.18728E-03   504   0.162E-01    0.501E-02
DAV:  16    -0.134560122771E+03   -0.33964E-02   -0.35801E-04   456   0.767E-02    0.358E-02
DAV:  17    -0.134563452172E+03   -0.33294E-02   -0.49957E-04   496   0.715E-02    0.129E-02
DAV:  18    -0.134564776296E+03   -0.13241E-02   -0.96946E-05   472   0.342E-02    0.154E-02
DAV:  19    -0.134565570959E+03   -0.79466E-03   -0.46650E-05   448   0.227E-02    0.624E-03
DAV:  20    -0.134565928626E+03   -0.35767E-03   -0.41641E-05   448   0.227E-02    0.786E-03
DAV:  21    -0.134566012253E+03   -0.83627E-04   -0.87687E-06   344   0.154E-02    0.306E-03
DAV:  22    -0.134566052002E+03   -0.39749E-04   -0.33610E-06   328   0.733E-03    0.221E-03
DAV:  23    -0.134566085118E+03   -0.33116E-04   -0.22579E-06   336   0.632E-03    0.129E-03
DAV:  24    -0.134566108074E+03   -0.22957E-04   -0.26001E-06   320   0.550E-03    0.185E-03
DAV:  25    -0.134566109764E+03   -0.16899E-05   -0.65407E-07   368   0.343E-03 
   1 F= -.13456611E+03 E0= -.13457187E+03  d E =0.172786E-01