./iterations/neb0_image02_iter4_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     0.403888944259E+03    0.40389E+03   -0.15919E+04   424   0.706E+02 
DAV:   2    -0.128050459353E+02   -0.41669E+03   -0.39837E+03   587   0.166E+02 
DAV:   3    -0.139353984684E+03   -0.12655E+03   -0.12582E+03   513   0.973E+01 
DAV:   4    -0.148946532259E+03   -0.95925E+01   -0.95664E+01   464   0.327E+01 
DAV:   5    -0.149225057368E+03   -0.27853E+00   -0.27839E+00   528   0.511E+00    0.248E+01
DAV:   6    -0.136773919974E+03    0.12451E+02   -0.37621E+01   457   0.259E+01    0.131E+01
DAV:   7    -0.135333316573E+03    0.14406E+01   -0.48701E+00   496   0.893E+00    0.602E+00
DAV:   8    -0.134706575626E+03    0.62674E+00   -0.90725E-01   488   0.437E+00    0.211E+00
DAV:   9    -0.134549979270E+03    0.15660E+00   -0.29707E-01   480   0.217E+00    0.594E-01
DAV:  10    -0.134530731313E+03    0.19248E-01   -0.48899E-02   472   0.946E-01    0.395E-01
DAV:  11    -0.134522222130E+03    0.85092E-02   -0.93048E-03   464   0.435E-01    0.173E-01
DAV:  12    -0.134517858094E+03    0.43640E-02   -0.76353E-03   464   0.301E-01    0.126E-01
DAV:  13    -0.134521940398E+03   -0.40823E-02   -0.40428E-03   473   0.275E-01    0.908E-02
DAV:  14    -0.134528213797E+03   -0.62734E-02   -0.22390E-03   456   0.191E-01    0.568E-02
DAV:  15    -0.134533917481E+03   -0.57037E-02   -0.15853E-03   528   0.154E-01    0.523E-02
DAV:  16    -0.134537342220E+03   -0.34247E-02   -0.38898E-04   480   0.779E-02    0.310E-02
DAV:  17    -0.134540267387E+03   -0.29252E-02   -0.40670E-04   464   0.660E-02    0.131E-02
DAV:  18    -0.134541523760E+03   -0.12564E-02   -0.96828E-05   496   0.326E-02    0.159E-02
DAV:  19    -0.134542160988E+03   -0.63723E-03   -0.29924E-05   408   0.211E-02    0.570E-03
DAV:  20    -0.134542633429E+03   -0.47244E-03   -0.58461E-05   489   0.245E-02    0.900E-03
DAV:  21    -0.134542687892E+03   -0.54463E-04   -0.88862E-06   352   0.160E-02    0.300E-03
DAV:  22    -0.134542753957E+03   -0.66066E-04   -0.12559E-05   345   0.128E-02    0.481E-03
DAV:  23    -0.134542777367E+03   -0.23410E-04   -0.16134E-06   336   0.714E-03    0.301E-03
DAV:  24    -0.134542794507E+03   -0.17139E-04   -0.24412E-06   328   0.586E-03    0.114E-03
DAV:  25    -0.134542798770E+03   -0.42631E-05   -0.51635E-07   352   0.356E-03 
   1 F= -.13454280E+03 E0= -.13454863E+03  d E =0.174844E-01