./iterations/neb0_image02_iter13_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 0.144805111410E+04 0.14481E+04 -0.44193E+04 330 0.697E+02
DAV: 2 0.224461276555E+03 -0.12236E+04 -0.11470E+04 435 0.163E+02
DAV: 3 -0.362853135816E+03 -0.58731E+03 -0.58418E+03 345 0.114E+02
DAV: 4 -0.433458997231E+03 -0.70606E+02 -0.70369E+02 309 0.508E+01
DAV: 5 -0.435043073304E+03 -0.15841E+01 -0.15815E+01 318 0.781E+00 0.426E+01
DAV: 6 -0.389085767139E+03 0.45957E+02 -0.14800E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385618561489E+03 0.34672E+01 -0.13401E+01 345 0.778E+00 0.104E+01
DAV: 8 -0.384140524679E+03 0.14780E+01 -0.20297E+00 336 0.381E+00 0.430E+00
DAV: 9 -0.383593943012E+03 0.54658E+00 -0.12497E+00 345 0.230E+00 0.119E+00
DAV: 10 -0.383527324184E+03 0.66619E-01 -0.14481E-01 327 0.103E+00 0.103E+00
DAV: 11 -0.383511922521E+03 0.15402E-01 -0.33292E-01 381 0.705E-01 0.110E+00
DAV: 12 -0.383505144876E+03 0.67776E-02 -0.39951E-01 327 0.744E-01 0.124E+00
DAV: 13 -0.383469009605E+03 0.36135E-01 -0.80527E-02 363 0.575E-01 0.613E-01
DAV: 14 -0.383465401600E+03 0.36080E-02 -0.11371E-02 309 0.295E-01 0.506E-01
DAV: 15 -0.383458447028E+03 0.69546E-02 -0.15929E-02 363 0.387E-01 0.365E-01
DAV: 16 -0.383457883134E+03 0.56389E-03 -0.16770E-02 345 0.326E-01 0.310E-01
DAV: 17 -0.383461524108E+03 -0.36410E-02 -0.53776E-03 309 0.216E-01 0.179E-01
DAV: 18 -0.383470417134E+03 -0.88930E-02 -0.27538E-03 291 0.172E-01 0.125E-01
DAV: 19 -0.383482484905E+03 -0.12068E-01 -0.35255E-03 309 0.156E-01 0.843E-02
DAV: 20 -0.383491883733E+03 -0.93988E-02 -0.14362E-03 318 0.117E-01 0.888E-02
DAV: 21 -0.383495709100E+03 -0.38254E-02 -0.35117E-04 345 0.567E-02 0.492E-02
DAV: 22 -0.383499568153E+03 -0.38591E-02 -0.18607E-04 318 0.327E-02 0.303E-02
DAV: 23 -0.383504019671E+03 -0.44515E-02 -0.16872E-04 309 0.293E-02 0.231E-02
DAV: 24 -0.383506881761E+03 -0.28621E-02 -0.12266E-04 291 0.248E-02 0.130E-02
DAV: 25 -0.383509025750E+03 -0.21440E-02 -0.12670E-04 291 0.207E-02 0.115E-02
DAV: 26 -0.383509772500E+03 -0.74675E-03 -0.26182E-05 255 0.141E-02 0.874E-03
DAV: 27 -0.383510201080E+03 -0.42858E-03 -0.21815E-05 255 0.105E-02 0.746E-03
DAV: 28 -0.383510319997E+03 -0.11892E-03 -0.27234E-06 237 0.488E-03 0.365E-03
DAV: 29 -0.383510514073E+03 -0.19408E-03 -0.99647E-06 201 0.840E-03 0.527E-03
DAV: 30 -0.383510558713E+03 -0.44640E-04 -0.22397E-06 228 0.436E-03 0.327E-03
DAV: 31 -0.383510582734E+03 -0.24021E-04 -0.18131E-06 210 0.383E-03 0.222E-03
DAV: 32 -0.383510609638E+03 -0.26904E-04 -0.96482E-07 201 0.268E-03 0.138E-03
DAV: 33 -0.383510624656E+03 -0.15018E-04 -0.72429E-07 228 0.181E-03 0.189E-03
DAV: 34 -0.383510630928E+03 -0.62730E-05 -0.26659E-07 210 0.131E-03
1 F= -.38351063E+03 E0= -.38352724E+03 d E =0.498406E-01