./iterations/neb0_image04_iter3_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     0.403936848013E+03    0.40394E+03   -0.15913E+04   424   0.706E+02 
DAV:   2    -0.134168647139E+02   -0.41735E+03   -0.39842E+03   601   0.166E+02 
DAV:   3    -0.140566073860E+03   -0.12715E+03   -0.12650E+03   536   0.973E+01 
DAV:   4    -0.149004265375E+03   -0.84382E+01   -0.84210E+01   464   0.307E+01 
DAV:   5    -0.149233088556E+03   -0.22882E+00   -0.22871E+00   528   0.465E+00    0.248E+01
DAV:   6    -0.136829574985E+03    0.12404E+02   -0.37650E+01   443   0.257E+01    0.131E+01
DAV:   7    -0.135378913910E+03    0.14507E+01   -0.46985E+00   496   0.882E+00    0.601E+00
DAV:   8    -0.134748471075E+03    0.63044E+00   -0.92453E-01   488   0.436E+00    0.210E+00
DAV:   9    -0.134593405342E+03    0.15507E+00   -0.28928E-01   480   0.216E+00    0.596E-01
DAV:  10    -0.134573561652E+03    0.19844E-01   -0.48962E-02   472   0.930E-01    0.401E-01
DAV:  11    -0.134564436300E+03    0.91254E-02   -0.97148E-03   504   0.435E-01    0.172E-01
DAV:  12    -0.134558917307E+03    0.55190E-02   -0.80221E-03   480   0.318E-01    0.127E-01
DAV:  13    -0.134563833576E+03   -0.49163E-02   -0.65657E-03   465   0.332E-01    0.104E-01
DAV:  14    -0.134569655325E+03   -0.58217E-02   -0.21577E-03   488   0.199E-01    0.588E-02
DAV:  15    -0.134574545385E+03   -0.48901E-02   -0.16047E-03   496   0.150E-01    0.487E-02
DAV:  16    -0.134577414501E+03   -0.28691E-02   -0.32649E-04   496   0.742E-02    0.273E-02
DAV:  17    -0.134581544167E+03   -0.41297E-02   -0.56838E-04   449   0.745E-02    0.173E-02
DAV:  18    -0.134582722676E+03   -0.11785E-02   -0.90549E-05   472   0.338E-02    0.166E-02
DAV:  19    -0.134583526040E+03   -0.80336E-03   -0.11311E-04   528   0.430E-02    0.125E-02
DAV:  20    -0.134583815646E+03   -0.28961E-03   -0.21313E-05   416   0.219E-02    0.979E-03
DAV:  21    -0.134584025841E+03   -0.21020E-03   -0.19757E-05   361   0.163E-02    0.608E-03
DAV:  22    -0.134584083372E+03   -0.57531E-04   -0.91932E-06   360   0.115E-02    0.225E-03
DAV:  23    -0.134584139009E+03   -0.55637E-04   -0.41790E-06   320   0.815E-03    0.260E-03
DAV:  24    -0.134584162065E+03   -0.23056E-04   -0.18246E-06   336   0.475E-03    0.250E-03
DAV:  25    -0.134584171056E+03   -0.89914E-05   -0.15897E-06   336   0.518E-03 
   1 F= -.13458417E+03 E0= -.13459023E+03  d E =0.181701E-01