iterations/neb0_image01_iter5_OSZICAR.out output for 3: !!! 3.3A-->1.3A 709 (amd-9) Si-H2N...HCH2-Si two dimer (TSS)
Status:
terminated
N E dE d eps ncg rms rms(c)
DAV: 1 0.144725203275E+04 0.14473E+04 -0.44194E+04 330 0.697E+02
DAV: 2 0.224165027655E+03 -0.12231E+04 -0.11459E+04 435 0.163E+02
DAV: 3 -0.363090151578E+03 -0.58726E+03 -0.58382E+03 345 0.114E+02
DAV: 4 -0.433520743090E+03 -0.70431E+02 -0.70155E+02 318 0.508E+01
DAV: 5 -0.435092834818E+03 -0.15721E+01 -0.15696E+01 318 0.779E+00 0.426E+01
DAV: 6 -0.389102971908E+03 0.45990E+02 -0.14807E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385628783263E+03 0.34742E+01 -0.13522E+01 345 0.779E+00 0.104E+01
DAV: 8 -0.384150207450E+03 0.14786E+01 -0.20867E+00 327 0.381E+00 0.432E+00
DAV: 9 -0.383607515802E+03 0.54269E+00 -0.17007E+00 336 0.242E+00 0.139E+00
DAV: 10 -0.383544750106E+03 0.62766E-01 -0.38240E-01 318 0.115E+00 0.104E+00
DAV: 11 -0.383513839436E+03 0.30911E-01 -0.18490E-01 336 0.641E-01 0.941E-01
DAV: 12 -0.383492934265E+03 0.20905E-01 -0.23616E-01 327 0.706E-01 0.867E-01
DAV: 13 -0.383478797454E+03 0.14137E-01 -0.16952E-01 354 0.538E-01 0.746E-01
DAV: 14 -0.383464806837E+03 0.13991E-01 -0.64951E-02 345 0.397E-01 0.419E-01
DAV: 15 -0.383462355547E+03 0.24513E-02 -0.20187E-02 309 0.379E-01 0.325E-01
DAV: 16 -0.383466894663E+03 -0.45391E-02 -0.12808E-02 327 0.267E-01 0.211E-01
DAV: 17 -0.383473686794E+03 -0.67921E-02 -0.27318E-03 282 0.158E-01 0.167E-01
DAV: 18 -0.383483820956E+03 -0.10134E-01 -0.36448E-03 372 0.201E-01 0.153E-01
DAV: 19 -0.383488293853E+03 -0.44729E-02 -0.25524E-03 345 0.139E-01 0.923E-02
DAV: 20 -0.383494984249E+03 -0.66904E-02 -0.18979E-03 327 0.920E-02 0.160E-01
DAV: 21 -0.383494847051E+03 0.13720E-03 -0.37621E-03 327 0.835E-02 0.133E-01
DAV: 22 -0.383499548490E+03 -0.47014E-02 -0.61081E-04 291 0.591E-02 0.945E-02
DAV: 23 -0.383504813620E+03 -0.52651E-02 -0.12849E-03 318 0.621E-02 0.598E-02
DAV: 24 -0.383508839590E+03 -0.40260E-02 -0.31880E-04 309 0.383E-02 0.473E-02
DAV: 25 -0.383510202097E+03 -0.13625E-02 -0.11348E-04 336 0.281E-02 0.196E-02
DAV: 26 -0.383511488998E+03 -0.12869E-02 -0.86649E-05 309 0.208E-02 0.206E-02
DAV: 27 -0.383512275267E+03 -0.78627E-03 -0.31069E-05 273 0.125E-02 0.149E-02
DAV: 28 -0.383512923586E+03 -0.64832E-03 -0.30754E-05 282 0.103E-02 0.117E-02
DAV: 29 -0.383513124632E+03 -0.20105E-03 -0.18105E-05 264 0.902E-03 0.559E-03
DAV: 30 -0.383513348845E+03 -0.22421E-03 -0.10001E-05 210 0.693E-03 0.403E-03
DAV: 31 -0.383513420416E+03 -0.71570E-04 -0.28185E-06 228 0.342E-03 0.273E-03
DAV: 32 -0.383513472025E+03 -0.51609E-04 -0.19293E-06 210 0.300E-03 0.216E-03
DAV: 33 -0.383513520621E+03 -0.48596E-04 -0.21743E-06 210 0.298E-03 0.278E-03
DAV: 34 -0.383513534049E+03 -0.13428E-04 -0.66184E-07 228 0.181E-03 0.160E-03
DAV: 35 -0.383513544864E+03 -0.10815E-04 -0.66361E-07 201 0.190E-03 0.103E-03
DAV: 36 -0.383513552762E+03 -0.78971E-05 -0.38624E-07 210 0.129E-03
1 F= -.38351355E+03 E0= -.38353022E+03 d E =0.500015E-01