iterations/neb0_image07_iter67_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 0.145589503767E+04 0.14559E+04 -0.44287E+04 330 0.697E+02
DAV: 2 0.232578058934E+03 -0.12233E+04 -0.11455E+04 417 0.163E+02
DAV: 3 -0.365927686176E+03 -0.59851E+03 -0.59508E+03 363 0.116E+02
DAV: 4 -0.433509442458E+03 -0.67582E+02 -0.67332E+02 309 0.492E+01
DAV: 5 -0.435002238126E+03 -0.14928E+01 -0.14899E+01 327 0.752E+00 0.431E+01
DAV: 6 -0.388143555650E+03 0.46859E+02 -0.15156E+02 309 0.288E+01 0.212E+01
DAV: 7 -0.384550703128E+03 0.35929E+01 -0.13654E+01 336 0.796E+00 0.105E+01
DAV: 8 -0.383091446510E+03 0.14593E+01 -0.20523E+00 336 0.393E+00 0.444E+00
DAV: 9 -0.382523747890E+03 0.56770E+00 -0.16054E+00 327 0.245E+00 0.120E+00
DAV: 10 -0.382458660919E+03 0.65087E-01 -0.14516E-01 336 0.105E+00 0.871E-01
DAV: 11 -0.382431615589E+03 0.27045E-01 -0.16437E-01 354 0.616E-01 0.906E-01
DAV: 12 -0.382409985403E+03 0.21630E-01 -0.19914E-01 363 0.536E-01 0.535E-01
DAV: 13 -0.382396524840E+03 0.13461E-01 -0.11470E-02 318 0.320E-01 0.402E-01
DAV: 14 -0.382389024387E+03 0.75005E-02 -0.28022E-02 318 0.469E-01 0.238E-01
DAV: 15 -0.382393009569E+03 -0.39852E-02 -0.12023E-02 336 0.304E-01 0.134E-01
DAV: 16 -0.382402515221E+03 -0.95057E-02 -0.27561E-03 300 0.166E-01 0.901E-02
DAV: 17 -0.382413304594E+03 -0.10789E-01 -0.27184E-03 309 0.153E-01 0.648E-02
DAV: 18 -0.382420331388E+03 -0.70268E-02 -0.11448E-03 336 0.102E-01 0.505E-02
DAV: 19 -0.382426700619E+03 -0.63692E-02 -0.52162E-04 345 0.694E-02 0.369E-02
DAV: 20 -0.382430786728E+03 -0.40861E-02 -0.14864E-04 336 0.337E-02 0.234E-02
DAV: 21 -0.382436852383E+03 -0.60657E-02 -0.43190E-04 291 0.409E-02 0.161E-02
DAV: 22 -0.382438580615E+03 -0.17282E-02 -0.69773E-05 318 0.187E-02 0.128E-02
DAV: 23 -0.382439726495E+03 -0.11459E-02 -0.73975E-05 300 0.205E-02 0.994E-03
DAV: 24 -0.382440413173E+03 -0.68668E-03 -0.20907E-05 237 0.121E-02 0.497E-03
DAV: 25 -0.382440801725E+03 -0.38855E-03 -0.24404E-05 255 0.104E-02 0.401E-03
DAV: 26 -0.382440911468E+03 -0.10974E-03 -0.25409E-06 237 0.595E-03 0.199E-03
DAV: 27 -0.382441043212E+03 -0.13174E-03 -0.68582E-06 192 0.664E-03 0.412E-03
DAV: 28 -0.382441078513E+03 -0.35301E-04 -0.15824E-06 219 0.505E-03 0.200E-03
DAV: 29 -0.382441114862E+03 -0.36349E-04 -0.89697E-06 210 0.878E-03 0.502E-03
DAV: 30 -0.382441122000E+03 -0.71376E-05 -0.15850E-06 228 0.468E-03
1 F= -.38244112E+03 E0= -.38245359E+03 d E =0.373943E-01