iterations/neb0_image01_iter41_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 0.140071232449E+04 0.14007E+04 -0.43818E+04 330 0.697E+02
DAV: 2 0.219565974888E+03 -0.11811E+04 -0.11079E+04 426 0.161E+02
DAV: 3 -0.346250819346E+03 -0.56582E+03 -0.56087E+03 345 0.111E+02
DAV: 4 -0.419531575038E+03 -0.73281E+02 -0.72763E+02 309 0.504E+01
DAV: 5 -0.421412971828E+03 -0.18814E+01 -0.18767E+01 336 0.819E+00 0.408E+01
DAV: 6 -0.377461301315E+03 0.43952E+02 -0.14369E+02 318 0.281E+01 0.202E+01
DAV: 7 -0.374272693577E+03 0.31886E+01 -0.11772E+01 354 0.860E+00 0.105E+01
DAV: 8 -0.372761429984E+03 0.15113E+01 -0.28923E+00 327 0.438E+00 0.434E+00
DAV: 9 -0.372223551255E+03 0.53788E+00 -0.73751E-01 327 0.222E+00 0.116E+00
DAV: 10 -0.372156241057E+03 0.67310E-01 -0.20255E-01 345 0.106E+00 0.866E-01
DAV: 11 -0.372138495445E+03 0.17746E-01 -0.32761E-02 363 0.554E-01 0.660E-01
DAV: 12 -0.372117167362E+03 0.21328E-01 -0.14153E-02 345 0.414E-01 0.361E-01
DAV: 13 -0.372108536305E+03 0.86311E-02 -0.17904E-02 327 0.413E-01 0.354E-01
DAV: 14 -0.372109556202E+03 -0.10199E-02 -0.10900E-02 345 0.297E-01 0.279E-01
DAV: 15 -0.372117072832E+03 -0.75166E-02 -0.36651E-03 309 0.205E-01 0.154E-01
DAV: 16 -0.372132056523E+03 -0.14984E-01 -0.51692E-03 318 0.227E-01 0.161E-01
DAV: 17 -0.372142368438E+03 -0.10312E-01 -0.36192E-03 327 0.192E-01 0.773E-02
DAV: 18 -0.372147556653E+03 -0.51882E-02 -0.10874E-03 309 0.883E-02 0.675E-02
DAV: 19 -0.372153423380E+03 -0.58667E-02 -0.28076E-04 327 0.402E-02 0.461E-02
DAV: 20 -0.372161577436E+03 -0.81541E-02 -0.58508E-04 318 0.506E-02 0.391E-02
DAV: 21 -0.372164768160E+03 -0.31907E-02 -0.18846E-04 354 0.355E-02 0.190E-02
DAV: 22 -0.372166394273E+03 -0.16261E-02 -0.86792E-05 318 0.221E-02 0.122E-02
DAV: 23 -0.372167551392E+03 -0.11571E-02 -0.35000E-05 282 0.138E-02 0.683E-03
DAV: 24 -0.372168690675E+03 -0.11393E-02 -0.53160E-05 282 0.122E-02 0.483E-03
DAV: 25 -0.372169112841E+03 -0.42217E-03 -0.13596E-05 246 0.830E-03 0.291E-03
DAV: 26 -0.372169327247E+03 -0.21441E-03 -0.83003E-06 228 0.573E-03 0.373E-03
DAV: 27 -0.372169433028E+03 -0.10578E-03 -0.29073E-06 228 0.415E-03 0.184E-03
DAV: 28 -0.372169517592E+03 -0.84565E-04 -0.29936E-06 219 0.361E-03 0.123E-03
DAV: 29 -0.372169548956E+03 -0.31363E-04 -0.12427E-06 228 0.268E-03 0.982E-04
DAV: 30 -0.372169570033E+03 -0.21077E-04 -0.78374E-07 219 0.180E-03 0.846E-04
DAV: 31 -0.372169581001E+03 -0.10969E-04 -0.41074E-07 219 0.126E-03 0.396E-04
DAV: 32 -0.372169586045E+03 -0.50436E-05 -0.24424E-07 228 0.986E-04
1 F= -.37216959E+03 E0= -.37218305E+03 d E =0.403791E-01