iterations/neb0_image01_iter69_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 0.144666515150E+04 0.14467E+04 -0.44189E+04 330 0.697E+02
DAV: 2 0.224121696096E+03 -0.12225E+04 -0.11455E+04 435 0.163E+02
DAV: 3 -0.362951186643E+03 -0.58707E+03 -0.58363E+03 345 0.114E+02
DAV: 4 -0.433430569310E+03 -0.70479E+02 -0.70205E+02 318 0.508E+01
DAV: 5 -0.435004919267E+03 -0.15743E+01 -0.15718E+01 318 0.779E+00 0.426E+01
DAV: 6 -0.389052546822E+03 0.45952E+02 -0.14799E+02 309 0.286E+01 0.208E+01
DAV: 7 -0.385596262595E+03 0.34563E+01 -0.13818E+01 345 0.783E+00 0.104E+01
DAV: 8 -0.384119512671E+03 0.14767E+01 -0.21718E+00 327 0.386E+00 0.437E+00
DAV: 9 -0.383553131039E+03 0.56638E+00 -0.94772E-01 336 0.239E+00 0.121E+00
DAV: 10 -0.383496209513E+03 0.56922E-01 -0.17706E-01 318 0.107E+00 0.835E-01
DAV: 11 -0.383463890261E+03 0.32319E-01 -0.44966E-02 318 0.502E-01 0.630E-01
DAV: 12 -0.383437283578E+03 0.26607E-01 -0.39578E-02 345 0.582E-01 0.554E-01
DAV: 13 -0.383430098300E+03 0.71853E-02 -0.36259E-02 363 0.500E-01 0.596E-01
DAV: 14 -0.383422704793E+03 0.73935E-02 -0.10383E-02 318 0.315E-01 0.239E-01
DAV: 15 -0.383424989116E+03 -0.22843E-02 -0.66627E-03 300 0.252E-01 0.215E-01
DAV: 16 -0.383432248122E+03 -0.72590E-02 -0.87469E-03 300 0.236E-01 0.338E-01
DAV: 17 -0.383434291654E+03 -0.20435E-02 -0.21982E-03 318 0.128E-01 0.125E-01
DAV: 18 -0.383444735522E+03 -0.10444E-01 -0.21144E-03 291 0.124E-01 0.746E-02
DAV: 19 -0.383455253885E+03 -0.10518E-01 -0.18150E-03 327 0.116E-01 0.483E-02
DAV: 20 -0.383462547028E+03 -0.72931E-02 -0.77553E-04 318 0.798E-02 0.536E-02
DAV: 21 -0.383468430729E+03 -0.58837E-02 -0.26879E-04 309 0.403E-02 0.412E-02
DAV: 22 -0.383472845609E+03 -0.44149E-02 -0.23773E-04 300 0.341E-02 0.323E-02
DAV: 23 -0.383473974904E+03 -0.11293E-02 -0.42870E-05 309 0.175E-02 0.119E-02
DAV: 24 -0.383475739565E+03 -0.17647E-02 -0.75918E-05 282 0.160E-02 0.813E-03
DAV: 25 -0.383476805504E+03 -0.10659E-02 -0.48767E-05 300 0.116E-02 0.557E-03
DAV: 26 -0.383477217483E+03 -0.41198E-03 -0.10231E-05 228 0.639E-03 0.362E-03
DAV: 27 -0.383477463175E+03 -0.24569E-03 -0.10292E-05 219 0.541E-03 0.286E-03
DAV: 28 -0.383477561541E+03 -0.98366E-04 -0.31044E-06 228 0.384E-03 0.194E-03
DAV: 29 -0.383477622054E+03 -0.60513E-04 -0.21532E-06 192 0.298E-03 0.998E-04
DAV: 30 -0.383477644814E+03 -0.22760E-04 -0.12196E-06 219 0.221E-03 0.866E-04
DAV: 31 -0.383477653145E+03 -0.83306E-05 -0.39445E-07 228 0.130E-03
1 F= -.38347765E+03 E0= -.38349415E+03 d E =0.494864E-01