./iterations/neb1_max2_image01_iter34_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     0.419230238003E+03    0.41923E+03   -0.15806E+04   424   0.706E+02 
DAV:   2    -0.622107364367E+01   -0.42545E+03   -0.40582E+03   608   0.165E+02 
DAV:   3    -0.139557966286E+03   -0.13334E+03   -0.13262E+03   544   0.993E+01 
DAV:   4    -0.148704482075E+03   -0.91465E+01   -0.91237E+01   464   0.319E+01 
DAV:   5    -0.148949050057E+03   -0.24457E+00   -0.24442E+00   520   0.485E+00    0.249E+01
DAV:   6    -0.136457924666E+03    0.12491E+02   -0.35774E+01   464   0.254E+01    0.132E+01
DAV:   7    -0.134947595020E+03    0.15103E+01   -0.52550E+00   496   0.935E+00    0.597E+00
DAV:   8    -0.134322983592E+03    0.62461E+00   -0.93911E-01   488   0.445E+00    0.211E+00
DAV:   9    -0.134148506682E+03    0.17448E+00   -0.28788E-01   488   0.222E+00    0.581E-01
DAV:  10    -0.134124428131E+03    0.24079E-01   -0.70371E-02   488   0.113E+00    0.412E-01
DAV:  11    -0.134114732483E+03    0.96956E-02   -0.12027E-02   472   0.570E-01    0.173E-01
DAV:  12    -0.134110523539E+03    0.42089E-02   -0.77132E-03   472   0.395E-01    0.140E-01
DAV:  13    -0.134113184504E+03   -0.26610E-02   -0.52712E-03   497   0.400E-01    0.100E-01
DAV:  14    -0.134121074209E+03   -0.78897E-02   -0.36549E-03   456   0.272E-01    0.865E-02
DAV:  15    -0.134125921661E+03   -0.48475E-02   -0.15658E-03   504   0.190E-01    0.434E-02
DAV:  16    -0.134129277218E+03   -0.33556E-02   -0.68453E-04   456   0.108E-01    0.504E-02
DAV:  17    -0.134131769523E+03   -0.24923E-02   -0.18348E-04   480   0.543E-02    0.348E-02
DAV:  18    -0.134134625512E+03   -0.28560E-02   -0.55732E-04   520   0.893E-02    0.181E-02
DAV:  19    -0.134134962781E+03   -0.33727E-03   -0.44528E-05   472   0.349E-02    0.146E-02
DAV:  20    -0.134135611880E+03   -0.64910E-03   -0.79520E-05   520   0.350E-02    0.102E-02
DAV:  21    -0.134136028909E+03   -0.41703E-03   -0.29995E-05   385   0.217E-02    0.553E-03
DAV:  22    -0.134136143804E+03   -0.11490E-03   -0.13007E-05   344   0.147E-02    0.257E-03
DAV:  23    -0.134136182939E+03   -0.39135E-04   -0.26302E-06   336   0.637E-03    0.179E-03
DAV:  24    -0.134136240980E+03   -0.58041E-04   -0.44550E-06   313   0.740E-03    0.196E-03
DAV:  25    -0.134136248516E+03   -0.75360E-05   -0.10152E-06   344   0.431E-03 
   1 F= -.13413625E+03 E0= -.13414179E+03  d E =0.166282E-01