iterations/neb0_image06_iter56_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 0.144746938895E+04 0.14475E+04 -0.44238E+04 330 0.697E+02
DAV: 2 0.231628695901E+03 -0.12158E+04 -0.11385E+04 417 0.163E+02
DAV: 3 -0.364566274106E+03 -0.59619E+03 -0.59287E+03 354 0.114E+02
DAV: 4 -0.432515704374E+03 -0.67949E+02 -0.67684E+02 309 0.494E+01
DAV: 5 -0.434028845891E+03 -0.15131E+01 -0.15104E+01 336 0.766E+00 0.427E+01
DAV: 6 -0.388021617262E+03 0.46007E+02 -0.15006E+02 309 0.287E+01 0.210E+01
DAV: 7 -0.384554417251E+03 0.34672E+01 -0.13092E+01 327 0.780E+00 0.104E+01
DAV: 8 -0.383085954595E+03 0.14685E+01 -0.20271E+00 327 0.384E+00 0.437E+00
DAV: 9 -0.382545288000E+03 0.54067E+00 -0.92491E-01 336 0.220E+00 0.108E+00
DAV: 10 -0.382476838884E+03 0.68449E-01 -0.12526E-01 336 0.924E-01 0.852E-01
DAV: 11 -0.382440649240E+03 0.36190E-01 -0.11997E-01 345 0.730E-01 0.782E-01
DAV: 12 -0.382418790939E+03 0.21858E-01 -0.40469E-02 354 0.462E-01 0.433E-01
DAV: 13 -0.382406707255E+03 0.12084E-01 -0.15314E-02 327 0.377E-01 0.288E-01
DAV: 14 -0.382402782998E+03 0.39243E-02 -0.68372E-03 336 0.297E-01 0.192E-01
DAV: 15 -0.382405869202E+03 -0.30862E-02 -0.52684E-03 309 0.244E-01 0.136E-01
DAV: 16 -0.382413160799E+03 -0.72916E-02 -0.44751E-03 318 0.208E-01 0.264E-01
DAV: 17 -0.382421575919E+03 -0.84151E-02 -0.40541E-03 300 0.180E-01 0.141E-01
DAV: 18 -0.382430619528E+03 -0.90436E-02 -0.23430E-03 300 0.133E-01 0.981E-02
DAV: 19 -0.382438822661E+03 -0.82031E-02 -0.10824E-03 327 0.829E-02 0.475E-02
DAV: 20 -0.382444612978E+03 -0.57903E-02 -0.27038E-04 309 0.407E-02 0.260E-02
DAV: 21 -0.382450051096E+03 -0.54381E-02 -0.30737E-04 318 0.334E-02 0.174E-02
DAV: 22 -0.382453116382E+03 -0.30653E-02 -0.15106E-04 300 0.216E-02 0.152E-02
DAV: 23 -0.382454497652E+03 -0.13813E-02 -0.63387E-05 309 0.157E-02 0.619E-03
DAV: 24 -0.382455054208E+03 -0.55656E-03 -0.12904E-05 237 0.806E-03 0.571E-03
DAV: 25 -0.382455509766E+03 -0.45556E-03 -0.20325E-05 246 0.756E-03 0.390E-03
DAV: 26 -0.382455647807E+03 -0.13804E-03 -0.31159E-06 228 0.400E-03 0.195E-03
DAV: 27 -0.382455755266E+03 -0.10746E-03 -0.38288E-06 192 0.444E-03 0.149E-03
DAV: 28 -0.382455785212E+03 -0.29946E-04 -0.11745E-06 228 0.241E-03 0.125E-03
DAV: 29 -0.382455808654E+03 -0.23442E-04 -0.95832E-07 192 0.237E-03 0.894E-04
DAV: 30 -0.382455825002E+03 -0.16347E-04 -0.62449E-07 228 0.163E-03 0.869E-04
DAV: 31 -0.382455832628E+03 -0.76262E-05 -0.34013E-07 210 0.129E-03
1 F= -.38245583E+03 E0= -.38247223E+03 d E =0.491881E-01