iterations/neb0_image08_iter15_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 0.145344632814E+04 0.14534E+04 -0.44261E+04 330 0.697E+02
DAV: 2 0.230486904573E+03 -0.12230E+04 -0.11475E+04 426 0.163E+02
DAV: 3 -0.360394349985E+03 -0.59088E+03 -0.58746E+03 345 0.114E+02
DAV: 4 -0.432746906040E+03 -0.72353E+02 -0.72063E+02 318 0.513E+01
DAV: 5 -0.434388027557E+03 -0.16411E+01 -0.16383E+01 318 0.797E+00 0.427E+01
DAV: 6 -0.388532489350E+03 0.45856E+02 -0.14718E+02 309 0.286E+01 0.209E+01
DAV: 7 -0.385064733558E+03 0.34678E+01 -0.13362E+01 345 0.788E+00 0.104E+01
DAV: 8 -0.383631036889E+03 0.14337E+01 -0.27474E+00 345 0.403E+00 0.437E+00
DAV: 9 -0.383103660638E+03 0.52738E+00 -0.14074E+00 336 0.236E+00 0.132E+00
DAV: 10 -0.383001572439E+03 0.10209E+00 -0.16917E-01 336 0.118E+00 0.967E-01
DAV: 11 -0.382995446907E+03 0.61255E-02 -0.39173E-01 363 0.110E+00 0.854E-01
DAV: 12 -0.382969799572E+03 0.25647E-01 -0.11237E-01 327 0.631E-01 0.820E-01
DAV: 13 -0.382959892040E+03 0.99075E-02 -0.69555E-02 336 0.331E-01 0.744E-01
DAV: 14 -0.382950177917E+03 0.97141E-02 -0.45015E-02 408 0.363E-01 0.461E-01
DAV: 15 -0.382943378335E+03 0.67996E-02 -0.47593E-02 318 0.464E-01 0.797E-01
DAV: 16 -0.382934581716E+03 0.87966E-02 -0.72719E-02 336 0.343E-01 0.205E-01
DAV: 17 -0.382939364390E+03 -0.47827E-02 -0.58684E-03 291 0.221E-01 0.155E-01
DAV: 18 -0.382949205405E+03 -0.98410E-02 -0.41272E-03 309 0.230E-01 0.151E-01
DAV: 19 -0.382960241368E+03 -0.11036E-01 -0.36539E-03 309 0.197E-01 0.111E-01
DAV: 20 -0.382967096370E+03 -0.68550E-02 -0.17937E-03 318 0.106E-01 0.727E-02
DAV: 21 -0.382973472588E+03 -0.63762E-02 -0.63853E-04 327 0.597E-02 0.112E-01
DAV: 22 -0.382977748491E+03 -0.42759E-02 -0.48223E-04 345 0.580E-02 0.279E-02
DAV: 23 -0.382981866172E+03 -0.41177E-02 -0.32434E-04 309 0.359E-02 0.265E-02
DAV: 24 -0.382984416985E+03 -0.25508E-02 -0.12792E-04 318 0.217E-02 0.242E-02
DAV: 25 -0.382986035736E+03 -0.16188E-02 -0.75725E-05 300 0.169E-02 0.123E-02
DAV: 26 -0.382987072775E+03 -0.10370E-02 -0.57270E-05 300 0.137E-02 0.113E-02
DAV: 27 -0.382987458957E+03 -0.38618E-03 -0.11120E-05 219 0.772E-03 0.892E-03
DAV: 28 -0.382987767038E+03 -0.30808E-03 -0.15790E-05 237 0.743E-03 0.868E-03
DAV: 29 -0.382987859689E+03 -0.92651E-04 -0.84142E-06 228 0.575E-03 0.414E-03
DAV: 30 -0.382987922224E+03 -0.62536E-04 -0.29007E-06 201 0.397E-03 0.323E-03
DAV: 31 -0.382987966694E+03 -0.44470E-04 -0.20316E-06 210 0.314E-03 0.225E-03
DAV: 32 -0.382987998198E+03 -0.31504E-04 -0.95242E-07 210 0.201E-03 0.199E-03
DAV: 33 -0.382988016601E+03 -0.18403E-04 -0.75810E-07 210 0.203E-03 0.767E-04
DAV: 34 -0.382988028457E+03 -0.11856E-04 -0.53652E-07 219 0.154E-03 0.122E-03
DAV: 35 -0.382988030431E+03 -0.19741E-05 -0.15427E-07 237 0.955E-04
1 F= -.38298803E+03 E0= -.38300492E+03 d E =0.506693E-01