./iterations/neb0_image02_iter3_OSZICAR.out output for 3: 3.3A-->1.3A 709 (amd-9) Si-H2N...HCH2-Si two dimer (TSS)
Status:
running
N E dE d eps ncg rms rms(c)
DAV: 1 0.144798646162E+04 0.14480E+04 -0.44193E+04 330 0.697E+02
DAV: 2 0.224442073034E+03 -0.12235E+04 -0.11470E+04 435 0.163E+02
DAV: 3 -0.362834883953E+03 -0.58728E+03 -0.58414E+03 345 0.114E+02
DAV: 4 -0.433451481406E+03 -0.70617E+02 -0.70378E+02 309 0.508E+01
DAV: 5 -0.435035673261E+03 -0.15842E+01 -0.15816E+01 318 0.781E+00 0.426E+01
DAV: 6 -0.389085334152E+03 0.45950E+02 -0.14800E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385620678360E+03 0.34647E+01 -0.13487E+01 345 0.778E+00 0.104E+01
DAV: 8 -0.384142713169E+03 0.14780E+01 -0.20554E+00 336 0.382E+00 0.432E+00
DAV: 9 -0.383603354982E+03 0.53936E+00 -0.16109E+00 354 0.241E+00 0.138E+00
DAV: 10 -0.383545645609E+03 0.57709E-01 -0.44677E-01 318 0.115E+00 0.984E-01
DAV: 11 -0.383505748374E+03 0.39897E-01 -0.96591E-02 336 0.641E-01 0.761E-01
DAV: 12 -0.383491601228E+03 0.14147E-01 -0.96480E-02 354 0.711E-01 0.989E-01
DAV: 13 -0.383473132781E+03 0.18468E-01 -0.18222E-01 354 0.530E-01 0.678E-01
DAV: 14 -0.383461691778E+03 0.11441E-01 -0.55309E-02 318 0.386E-01 0.295E-01
DAV: 15 -0.383458987854E+03 0.27039E-02 -0.12707E-02 318 0.374E-01 0.208E-01
DAV: 16 -0.383464582085E+03 -0.55942E-02 -0.62441E-03 327 0.252E-01 0.235E-01
DAV: 17 -0.383471852744E+03 -0.72707E-02 -0.45425E-03 336 0.224E-01 0.198E-01
DAV: 18 -0.383480078868E+03 -0.82261E-02 -0.46790E-03 309 0.171E-01 0.195E-01
DAV: 19 -0.383480163986E+03 -0.85118E-04 -0.13023E-03 345 0.882E-02 0.941E-02
DAV: 20 -0.383488110342E+03 -0.79464E-02 -0.87001E-04 291 0.821E-02 0.908E-02
DAV: 21 -0.383495231411E+03 -0.71211E-02 -0.79487E-04 318 0.767E-02 0.953E-02
DAV: 22 -0.383501699479E+03 -0.64681E-02 -0.15005E-03 327 0.721E-02 0.481E-02
DAV: 23 -0.383504588531E+03 -0.28891E-02 -0.24609E-04 309 0.354E-02 0.426E-02
DAV: 24 -0.383506189279E+03 -0.16007E-02 -0.59272E-05 309 0.161E-02 0.297E-02
DAV: 25 -0.383508294374E+03 -0.21051E-02 -0.17633E-04 327 0.244E-02 0.159E-02
DAV: 26 -0.383509230998E+03 -0.93662E-03 -0.42223E-05 309 0.134E-02 0.176E-02
DAV: 27 -0.383509641682E+03 -0.41068E-03 -0.12040E-05 246 0.877E-03 0.817E-03
DAV: 28 -0.383510234560E+03 -0.59288E-03 -0.32318E-05 264 0.109E-02 0.973E-03
DAV: 29 -0.383510375855E+03 -0.14129E-03 -0.57732E-06 228 0.755E-03 0.446E-03
DAV: 30 -0.383510465363E+03 -0.89508E-04 -0.57052E-06 219 0.577E-03 0.397E-03
DAV: 31 -0.383510512309E+03 -0.46947E-04 -0.16123E-06 219 0.366E-03 0.162E-03
DAV: 32 -0.383510566683E+03 -0.54374E-04 -0.18376E-06 210 0.282E-03 0.198E-03
DAV: 33 -0.383510595620E+03 -0.28937E-04 -0.94801E-07 219 0.281E-03 0.139E-03
DAV: 34 -0.383510607804E+03 -0.12184E-04 -0.93549E-07 219 0.249E-03 0.203E-03
DAV: 35 -0.383510614115E+03 -0.63102E-05 -0.27493E-07 210 0.129E-03
1 F= -.38351061E+03 E0= -.38352729E+03 d E =0.500402E-01