iterations/neb0_image06_iter64_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 0.144904209488E+04 0.14490E+04 -0.44241E+04 330 0.697E+02
DAV: 2 0.231349392692E+03 -0.12177E+04 -0.11408E+04 417 0.163E+02
DAV: 3 -0.363622573541E+03 -0.59497E+03 -0.59149E+03 354 0.114E+02
DAV: 4 -0.432952056096E+03 -0.69329E+02 -0.69065E+02 309 0.498E+01
DAV: 5 -0.434508147949E+03 -0.15561E+01 -0.15534E+01 336 0.772E+00 0.428E+01
DAV: 6 -0.388354690148E+03 0.46153E+02 -0.15037E+02 309 0.287E+01 0.209E+01
DAV: 7 -0.384899203266E+03 0.34555E+01 -0.13816E+01 336 0.787E+00 0.104E+01
DAV: 8 -0.383450245388E+03 0.14490E+01 -0.22781E+00 327 0.394E+00 0.445E+00
DAV: 9 -0.382902138637E+03 0.54811E+00 -0.16937E+00 354 0.245E+00 0.148E+00
DAV: 10 -0.382837000795E+03 0.65138E-01 -0.52493E-01 327 0.121E+00 0.845E-01
DAV: 11 -0.382800604167E+03 0.36397E-01 -0.58914E-02 336 0.627E-01 0.715E-01
DAV: 12 -0.382789702429E+03 0.10902E-01 -0.26843E-01 345 0.684E-01 0.111E+00
DAV: 13 -0.382762312475E+03 0.27390E-01 -0.23566E-01 327 0.588E-01 0.560E-01
DAV: 14 -0.382756589238E+03 0.57232E-02 -0.16300E-02 318 0.361E-01 0.398E-01
DAV: 15 -0.382754860345E+03 0.17289E-02 -0.96242E-03 300 0.326E-01 0.278E-01
DAV: 16 -0.382758402270E+03 -0.35419E-02 -0.85035E-03 363 0.253E-01 0.303E-01
DAV: 17 -0.382762758921E+03 -0.43567E-02 -0.30715E-03 309 0.187E-01 0.220E-01
DAV: 18 -0.382769031381E+03 -0.62725E-02 -0.20078E-03 318 0.133E-01 0.164E-01
DAV: 19 -0.382781506281E+03 -0.12475E-01 -0.28996E-03 300 0.167E-01 0.933E-02
DAV: 20 -0.382786478820E+03 -0.49725E-02 -0.15941E-03 354 0.111E-01 0.161E-01
DAV: 21 -0.382789235670E+03 -0.27569E-02 -0.27794E-04 318 0.477E-02 0.946E-02
DAV: 22 -0.382794417339E+03 -0.51817E-02 -0.43878E-04 318 0.483E-02 0.488E-02
DAV: 23 -0.382800310876E+03 -0.58935E-02 -0.43549E-04 309 0.485E-02 0.312E-02
DAV: 24 -0.382800850382E+03 -0.53951E-03 -0.87192E-05 336 0.222E-02 0.321E-02
DAV: 25 -0.382802163766E+03 -0.13134E-02 -0.42333E-05 291 0.148E-02 0.159E-02
DAV: 26 -0.382804051124E+03 -0.18874E-02 -0.10153E-04 300 0.181E-02 0.929E-03
DAV: 27 -0.382804627718E+03 -0.57659E-03 -0.26988E-05 273 0.127E-02 0.164E-02
DAV: 28 -0.382804848308E+03 -0.22059E-03 -0.82511E-06 237 0.839E-03 0.706E-03
DAV: 29 -0.382805064811E+03 -0.21650E-03 -0.89494E-06 201 0.618E-03 0.416E-03
DAV: 30 -0.382805132372E+03 -0.67561E-04 -0.21455E-06 228 0.337E-03 0.258E-03
DAV: 31 -0.382805222392E+03 -0.90021E-04 -0.30432E-06 192 0.373E-03 0.238E-03
DAV: 32 -0.382805243374E+03 -0.20981E-04 -0.11179E-06 228 0.225E-03 0.215E-03
DAV: 33 -0.382805256325E+03 -0.12952E-04 -0.56848E-07 228 0.177E-03 0.221E-03
DAV: 34 -0.382805275236E+03 -0.18911E-04 -0.62665E-07 192 0.175E-03 0.962E-04
DAV: 35 -0.382805281630E+03 -0.63940E-05 -0.37882E-07 219 0.139E-03
1 F= -.38280528E+03 E0= -.38282178E+03 d E =0.494862E-01