./iterations/neb1_max2_image01_iter33_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     0.419047533562E+03    0.41905E+03   -0.15805E+04   424   0.706E+02 
DAV:   2    -0.623507134584E+01   -0.42528E+03   -0.40568E+03   608   0.165E+02 
DAV:   3    -0.139522180416E+03   -0.13329E+03   -0.13257E+03   544   0.993E+01 
DAV:   4    -0.148688432521E+03   -0.91663E+01   -0.91432E+01   464   0.319E+01 
DAV:   5    -0.148933695898E+03   -0.24526E+00   -0.24511E+00   520   0.485E+00    0.248E+01
DAV:   6    -0.136443499721E+03    0.12490E+02   -0.35780E+01   464   0.255E+01    0.131E+01
DAV:   7    -0.134936899782E+03    0.15066E+01   -0.52783E+00   496   0.938E+00    0.597E+00
DAV:   8    -0.134312368215E+03    0.62453E+00   -0.94412E-01   488   0.446E+00    0.211E+00
DAV:   9    -0.134137197918E+03    0.17517E+00   -0.28808E-01   488   0.223E+00    0.581E-01
DAV:  10    -0.134113104971E+03    0.24093E-01   -0.71047E-02   488   0.114E+00    0.413E-01
DAV:  11    -0.134103657942E+03    0.94470E-02   -0.12071E-02   464   0.571E-01    0.176E-01
DAV:  12    -0.134099412322E+03    0.42456E-02   -0.78631E-03   472   0.396E-01    0.140E-01
DAV:  13    -0.134101840621E+03   -0.24283E-02   -0.50848E-03   497   0.392E-01    0.999E-02
DAV:  14    -0.134109948789E+03   -0.81082E-02   -0.38073E-03   456   0.277E-01    0.871E-02
DAV:  15    -0.134114660389E+03   -0.47116E-02   -0.15272E-03   504   0.187E-01    0.424E-02
DAV:  16    -0.134118080353E+03   -0.34200E-02   -0.76071E-04   456   0.112E-01    0.520E-02
DAV:  17    -0.134120525735E+03   -0.24454E-02   -0.18183E-04   496   0.570E-02    0.345E-02
DAV:  18    -0.134123455538E+03   -0.29298E-02   -0.62499E-04   520   0.938E-02    0.214E-02
DAV:  19    -0.134123709291E+03   -0.25375E-03   -0.46087E-05   472   0.347E-02    0.177E-02
DAV:  20    -0.134124282878E+03   -0.57359E-03   -0.76503E-05   528   0.354E-02    0.849E-03
DAV:  21    -0.134124809970E+03   -0.52709E-03   -0.36482E-05   393   0.201E-02    0.594E-03
DAV:  22    -0.134124918462E+03   -0.10849E-03   -0.79068E-06   336   0.113E-02    0.375E-03
DAV:  23    -0.134124987682E+03   -0.69220E-04   -0.39014E-06   321   0.647E-03    0.178E-03
DAV:  24    -0.134125028017E+03   -0.40335E-04   -0.42181E-06   328   0.705E-03    0.169E-03
DAV:  25    -0.134125035185E+03   -0.71680E-05   -0.10180E-06   344   0.397E-03 
   1 F= -.13412504E+03 E0= -.13413054E+03  d E =0.165133E-01