iterations/neb0_image02_iter39_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 0.145107254535E+04 0.14511E+04 -0.44200E+04 330 0.697E+02
DAV: 2 0.225599662157E+03 -0.12255E+04 -0.11469E+04 435 0.163E+02
DAV: 3 -0.362005023516E+03 -0.58760E+03 -0.58430E+03 345 0.114E+02
DAV: 4 -0.432360689846E+03 -0.70356E+02 -0.70096E+02 309 0.510E+01
DAV: 5 -0.433969214380E+03 -0.16085E+01 -0.16054E+01 336 0.786E+00 0.429E+01
DAV: 6 -0.387160184268E+03 0.46809E+02 -0.15295E+02 309 0.288E+01 0.210E+01
DAV: 7 -0.383687165422E+03 0.34730E+01 -0.12826E+01 336 0.784E+00 0.105E+01
DAV: 8 -0.382203860383E+03 0.14833E+01 -0.18076E+00 336 0.371E+00 0.421E+00
DAV: 9 -0.381628923182E+03 0.57494E+00 -0.58914E-01 336 0.187E+00 0.872E-01
DAV: 10 -0.381577109820E+03 0.51813E-01 -0.91273E-02 345 0.821E-01 0.617E-01
DAV: 11 -0.381546668547E+03 0.30441E-01 -0.16187E-02 318 0.402E-01 0.313E-01
DAV: 12 -0.381530868640E+03 0.15800E-01 -0.15779E-02 327 0.382E-01 0.190E-01
DAV: 13 -0.381533518967E+03 -0.26503E-02 -0.11871E-02 318 0.381E-01 0.135E-01
DAV: 14 -0.381547126720E+03 -0.13608E-01 -0.67771E-03 345 0.275E-01 0.107E-01
DAV: 15 -0.381558548628E+03 -0.11422E-01 -0.31824E-03 318 0.175E-01 0.548E-02
DAV: 16 -0.381565833291E+03 -0.72847E-02 -0.10534E-03 327 0.103E-01 0.571E-02
DAV: 17 -0.381570467552E+03 -0.46343E-02 -0.63720E-04 345 0.736E-02 0.589E-02
DAV: 18 -0.381569536922E+03 0.93063E-03 -0.11146E-04 309 0.279E-02 0.569E-02
DAV: 19 -0.381570214737E+03 -0.67781E-03 -0.32434E-05 282 0.131E-02 0.526E-02
DAV: 20 -0.381577107752E+03 -0.68930E-02 -0.67952E-04 327 0.629E-02 0.390E-02
DAV: 21 -0.381583113789E+03 -0.60060E-02 -0.97191E-04 363 0.759E-02 0.649E-02
DAV: 22 -0.381583818027E+03 -0.70424E-03 -0.20924E-04 327 0.419E-02 0.854E-02
DAV: 23 -0.381583839490E+03 -0.21463E-04 -0.24231E-05 300 0.122E-02 0.870E-02
DAV: 24 -0.381583985925E+03 -0.14644E-03 -0.17154E-05 255 0.152E-02 0.894E-02
DAV: 25 -0.381584065243E+03 -0.79317E-04 -0.51978E-04 345 0.866E-02 0.788E-02
DAV: 26 -0.381584399954E+03 -0.33471E-03 -0.55106E-04 336 0.613E-02 0.829E-02
DAV: 27 -0.381584334396E+03 0.65558E-04 -0.20593E-04 390 0.500E-02 0.105E-01
DAV: 28 -0.381584829933E+03 -0.49554E-03 -0.19174E-04 309 0.541E-02 0.575E-02
DAV: 29 -0.381586302899E+03 -0.14730E-02 -0.21590E-04 318 0.374E-02 0.468E-02
DAV: 30 -0.381587445737E+03 -0.11428E-02 -0.16856E-04 354 0.539E-02 0.369E-02
DAV: 31 -0.381588160992E+03 -0.71526E-03 -0.34930E-04 363 0.673E-02 0.462E-02
DAV: 32 -0.381588611773E+03 -0.45078E-03 -0.25458E-04 372 0.497E-02 0.640E-02
DAV: 33 -0.381588727185E+03 -0.11541E-03 -0.45933E-05 318 0.203E-02 0.694E-02
DAV: 34 -0.381588681603E+03 0.45582E-04 -0.65730E-06 219 0.854E-03 0.690E-02
DAV: 35 -0.381588669047E+03 0.12557E-04 -0.36758E-06 228 0.675E-03 0.673E-02
DAV: 36 -0.381588514371E+03 0.15468E-03 -0.41027E-04 345 0.850E-02 0.494E-02
DAV: 37 -0.381588286855E+03 0.22752E-03 -0.59902E-04 354 0.783E-02 0.557E-02
DAV: 38 -0.381588326981E+03 -0.40126E-04 -0.17933E-04 300 0.300E-02 0.420E-02
DAV: 39 -0.381588425091E+03 -0.98110E-04 -0.18350E-05 237 0.204E-02 0.367E-02
DAV: 40 -0.381588541020E+03 -0.11593E-03 -0.52059E-05 309 0.252E-02 0.367E-02
DAV: 41 -0.381588655731E+03 -0.11471E-03 -0.34676E-05 291 0.145E-02 0.462E-02
DAV: 42 -0.381588733413E+03 -0.77683E-04 -0.11705E-05 237 0.158E-02 0.481E-02
DAV: 43 -0.381588930096E+03 -0.19668E-03 -0.14799E-04 345 0.462E-02 0.573E-02
DAV: 44 -0.381589075159E+03 -0.14506E-03 -0.12121E-04 345 0.313E-02 0.704E-02
DAV: 45 -0.381589085371E+03 -0.10213E-04 -0.24304E-05 291 0.119E-02 0.778E-02
DAV: 46 -0.381589084322E+03 0.10497E-05 -0.68578E-07 210 0.205E-03
1 F= -.38158908E+03 E0= -.38159312E+03 d E =0.121110E-01