./iterations/neb0_image04_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     0.403987368787E+03    0.40399E+03   -0.15913E+04   424   0.706E+02 
DAV:   2    -0.133999697251E+02   -0.41739E+03   -0.39843E+03   601   0.166E+02 
DAV:   3    -0.140564282250E+03   -0.12716E+03   -0.12651E+03   536   0.973E+01 
DAV:   4    -0.149001468083E+03   -0.84372E+01   -0.84197E+01   464   0.307E+01 
DAV:   5    -0.149230024273E+03   -0.22856E+00   -0.22845E+00   528   0.465E+00    0.248E+01
DAV:   6    -0.136833747941E+03    0.12396E+02   -0.37604E+01   443   0.256E+01    0.131E+01
DAV:   7    -0.135379902986E+03    0.14538E+01   -0.46919E+00   496   0.882E+00    0.601E+00
DAV:   8    -0.134748983759E+03    0.63092E+00   -0.92763E-01   488   0.436E+00    0.209E+00
DAV:   9    -0.134594463479E+03    0.15452E+00   -0.28876E-01   480   0.216E+00    0.598E-01
DAV:  10    -0.134574565986E+03    0.19897E-01   -0.49486E-02   472   0.937E-01    0.402E-01
DAV:  11    -0.134565451596E+03    0.91144E-02   -0.95532E-03   504   0.435E-01    0.172E-01
DAV:  12    -0.134559908725E+03    0.55429E-02   -0.82120E-03   480   0.319E-01    0.128E-01
DAV:  13    -0.134564666401E+03   -0.47577E-02   -0.65133E-03   465   0.333E-01    0.106E-01
DAV:  14    -0.134570388990E+03   -0.57226E-02   -0.20937E-03   488   0.196E-01    0.619E-02
DAV:  15    -0.134575509262E+03   -0.51203E-02   -0.18102E-03   496   0.161E-01    0.492E-02
DAV:  16    -0.134578431428E+03   -0.29222E-02   -0.33020E-04   496   0.760E-02    0.311E-02
DAV:  17    -0.134582245199E+03   -0.38138E-02   -0.51556E-04   456   0.730E-02    0.169E-02
DAV:  18    -0.134583660817E+03   -0.14156E-02   -0.12616E-04   504   0.401E-02    0.173E-02
DAV:  19    -0.134584346478E+03   -0.68566E-03   -0.75500E-05   496   0.360E-02    0.101E-02
DAV:  20    -0.134584734652E+03   -0.38817E-03   -0.26290E-05   432   0.220E-02    0.761E-03
DAV:  21    -0.134584976779E+03   -0.24213E-03   -0.16555E-05   361   0.138E-02    0.599E-03
DAV:  22    -0.134585042676E+03   -0.65897E-04   -0.67915E-06   336   0.107E-02    0.190E-03
DAV:  23    -0.134585092972E+03   -0.50296E-04   -0.65447E-06   336   0.920E-03    0.356E-03
DAV:  24    -0.134585110237E+03   -0.17265E-04   -0.16500E-06   336   0.490E-03    0.233E-03
DAV:  25    -0.134585117567E+03   -0.73298E-05   -0.26422E-06   336   0.600E-03 
   1 F= -.13458512E+03 E0= -.13459108E+03  d E =0.178965E-01