iterations/neb0_image06_iter7_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 0.145142051179E+04 0.14514E+04 -0.44226E+04 330 0.697E+02
DAV: 2 0.227931480014E+03 -0.12235E+04 -0.11474E+04 426 0.163E+02
DAV: 3 -0.365330327586E+03 -0.59326E+03 -0.58995E+03 354 0.114E+02
DAV: 4 -0.433168519079E+03 -0.67838E+02 -0.67592E+02 309 0.490E+01
DAV: 5 -0.434660633801E+03 -0.14921E+01 -0.14895E+01 318 0.758E+00 0.427E+01
DAV: 6 -0.388817627605E+03 0.45843E+02 -0.14830E+02 309 0.286E+01 0.208E+01
DAV: 7 -0.385372363375E+03 0.34453E+01 -0.13245E+01 345 0.781E+00 0.104E+01
DAV: 8 -0.383930800089E+03 0.14416E+01 -0.23758E+00 336 0.391E+00 0.438E+00
DAV: 9 -0.383380035693E+03 0.55076E+00 -0.13755E+00 345 0.239E+00 0.124E+00
DAV: 10 -0.383305117650E+03 0.74918E-01 -0.17310E-01 327 0.115E+00 0.908E-01
DAV: 11 -0.383284698861E+03 0.20419E-01 -0.13390E-01 327 0.621E-01 0.744E-01
DAV: 12 -0.383252501032E+03 0.32198E-01 -0.61972E-02 381 0.619E-01 0.530E-01
DAV: 13 -0.383245474894E+03 0.70261E-02 -0.62498E-02 345 0.441E-01 0.626E-01
DAV: 14 -0.383238890321E+03 0.65846E-02 -0.16443E-02 354 0.352E-01 0.494E-01
DAV: 15 -0.383237390036E+03 0.15003E-02 -0.38694E-02 363 0.290E-01 0.333E-01
DAV: 16 -0.383240244256E+03 -0.28542E-02 -0.10833E-02 300 0.312E-01 0.202E-01
DAV: 17 -0.383245875208E+03 -0.56310E-02 -0.65907E-03 318 0.231E-01 0.186E-01
DAV: 18 -0.383256429836E+03 -0.10555E-01 -0.18357E-03 300 0.167E-01 0.143E-01
DAV: 19 -0.383265602167E+03 -0.91723E-02 -0.21502E-03 309 0.154E-01 0.502E-02
DAV: 20 -0.383273128691E+03 -0.75265E-02 -0.12309E-03 318 0.871E-02 0.664E-02
DAV: 21 -0.383277307317E+03 -0.41786E-02 -0.17010E-04 345 0.325E-02 0.621E-02
DAV: 22 -0.383282793790E+03 -0.54865E-02 -0.33763E-04 300 0.391E-02 0.456E-02
DAV: 23 -0.383284937757E+03 -0.21440E-02 -0.11680E-04 327 0.231E-02 0.237E-02
DAV: 24 -0.383286651223E+03 -0.17135E-02 -0.85049E-05 300 0.193E-02 0.105E-02
DAV: 25 -0.383287237519E+03 -0.58630E-03 -0.14862E-05 246 0.840E-03 0.126E-02
DAV: 26 -0.383288071197E+03 -0.83368E-03 -0.41580E-05 264 0.102E-02 0.767E-03
DAV: 27 -0.383288293784E+03 -0.22259E-03 -0.53997E-06 228 0.522E-03 0.377E-03
DAV: 28 -0.383288440637E+03 -0.14685E-03 -0.48555E-06 201 0.458E-03 0.217E-03
DAV: 29 -0.383288500393E+03 -0.59755E-04 -0.22543E-06 219 0.311E-03 0.205E-03
DAV: 30 -0.383288549003E+03 -0.48610E-04 -0.18505E-06 210 0.266E-03 0.190E-03
DAV: 31 -0.383288563264E+03 -0.14261E-04 -0.86311E-07 228 0.161E-03 0.106E-03
DAV: 32 -0.383288573212E+03 -0.99479E-05 -0.44907E-07 210 0.137E-03
1 F= -.38328857E+03 E0= -.38330519E+03 d E =0.498571E-01