./iterations/neb1_max1_image01_iter2_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     0.412923428117E+03    0.41292E+03   -0.15818E+04   424   0.706E+02 
DAV:   2    -0.100584384291E+02   -0.42298E+03   -0.40560E+03   595   0.165E+02 
DAV:   3    -0.140028869646E+03   -0.12997E+03   -0.12926E+03   528   0.982E+01 
DAV:   4    -0.148934265587E+03   -0.89054E+01   -0.88840E+01   464   0.317E+01 
DAV:   5    -0.149177865733E+03   -0.24360E+00   -0.24348E+00   528   0.483E+00    0.248E+01
DAV:   6    -0.136723501951E+03    0.12454E+02   -0.37509E+01   457   0.261E+01    0.131E+01
DAV:   7    -0.135295767997E+03    0.14277E+01   -0.49974E+00   496   0.904E+00    0.603E+00
DAV:   8    -0.134666252630E+03    0.62952E+00   -0.91659E-01   472   0.442E+00    0.211E+00
DAV:   9    -0.134507717374E+03    0.15854E+00   -0.30034E-01   472   0.219E+00    0.595E-01
DAV:  10    -0.134488184819E+03    0.19533E-01   -0.53788E-02   465   0.996E-01    0.395E-01
DAV:  11    -0.134480301094E+03    0.78837E-02   -0.96152E-03   464   0.451E-01    0.182E-01
DAV:  12    -0.134476464836E+03    0.38363E-02   -0.71006E-03   464   0.298E-01    0.122E-01
DAV:  13    -0.134479468435E+03   -0.30036E-02   -0.30195E-03   465   0.242E-01    0.866E-02
DAV:  14    -0.134487398454E+03   -0.79300E-02   -0.28175E-03   456   0.211E-01    0.511E-02
DAV:  15    -0.134492890655E+03   -0.54922E-02   -0.83667E-04   504   0.117E-01    0.425E-02
DAV:  16    -0.134496941440E+03   -0.40508E-02   -0.51686E-04   504   0.870E-02    0.324E-02
DAV:  17    -0.134498461108E+03   -0.15197E-02   -0.23718E-04   528   0.670E-02    0.118E-02
DAV:  18    -0.134500033480E+03   -0.15724E-02   -0.18644E-04   464   0.468E-02    0.182E-02
DAV:  19    -0.134500397435E+03   -0.36395E-03   -0.14486E-05   376   0.157E-02    0.126E-02
DAV:  20    -0.134500989956E+03   -0.59252E-03   -0.11474E-04   457   0.399E-02    0.111E-02
DAV:  21    -0.134501029063E+03   -0.39107E-04   -0.13744E-05   416   0.182E-02    0.826E-03
DAV:  22    -0.134501091934E+03   -0.62871E-04   -0.19510E-05   417   0.170E-02    0.292E-03
DAV:  23    -0.134501143108E+03   -0.51174E-04   -0.42303E-06   336   0.957E-03    0.148E-03
DAV:  24    -0.134501158161E+03   -0.15054E-04   -0.13846E-06   336   0.415E-03    0.124E-03
DAV:  25    -0.134501164734E+03   -0.65720E-05   -0.57505E-07   328   0.283E-03 
   1 F= -.13450116E+03 E0= -.13450617E+03  d E =0.150201E-01