./iterations/neb0_image09_iter15_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 0.145417496810E+04 0.14542E+04 -0.44276E+04 330 0.697E+02
DAV: 2 0.235664838791E+03 -0.12185E+04 -0.11433E+04 417 0.163E+02
DAV: 3 -0.361544058169E+03 -0.59721E+03 -0.59380E+03 354 0.114E+02
DAV: 4 -0.432521031287E+03 -0.70977E+02 -0.70690E+02 318 0.500E+01
DAV: 5 -0.434103123504E+03 -0.15821E+01 -0.15792E+01 318 0.780E+00 0.428E+01
DAV: 6 -0.388263152555E+03 0.45840E+02 -0.14789E+02 309 0.287E+01 0.209E+01
DAV: 7 -0.384801228382E+03 0.34619E+01 -0.13042E+01 345 0.785E+00 0.104E+01
DAV: 8 -0.383338528844E+03 0.14627E+01 -0.19394E+00 345 0.388E+00 0.433E+00
DAV: 9 -0.382821450542E+03 0.51708E+00 -0.15589E+00 345 0.238E+00 0.116E+00
DAV: 10 -0.382746990508E+03 0.74460E-01 -0.16610E-01 327 0.103E+00 0.931E-01
DAV: 11 -0.382725055074E+03 0.21935E-01 -0.15920E-01 336 0.640E-01 0.890E-01
DAV: 12 -0.382690498791E+03 0.34556E-01 -0.12860E-01 354 0.586E-01 0.518E-01
DAV: 13 -0.382674984271E+03 0.15515E-01 -0.17881E-02 318 0.408E-01 0.464E-01
DAV: 14 -0.382673271057E+03 0.17132E-02 -0.33126E-02 354 0.426E-01 0.451E-01
DAV: 15 -0.382669158054E+03 0.41130E-02 -0.23369E-02 318 0.396E-01 0.362E-01
DAV: 16 -0.382670134500E+03 -0.97645E-03 -0.63205E-03 318 0.190E-01 0.272E-01
DAV: 17 -0.382677968007E+03 -0.78335E-02 -0.10459E-02 291 0.214E-01 0.172E-01
DAV: 18 -0.382685114376E+03 -0.71464E-02 -0.28338E-03 300 0.173E-01 0.107E-01
DAV: 19 -0.382692165811E+03 -0.70514E-02 -0.15929E-03 318 0.108E-01 0.584E-02
DAV: 20 -0.382700816754E+03 -0.86509E-02 -0.61511E-04 300 0.818E-02 0.357E-02
DAV: 21 -0.382707321308E+03 -0.65046E-02 -0.57291E-04 327 0.647E-02 0.283E-02
DAV: 22 -0.382712288726E+03 -0.49674E-02 -0.44985E-04 309 0.467E-02 0.573E-02
DAV: 23 -0.382714757051E+03 -0.24683E-02 -0.16165E-04 318 0.262E-02 0.242E-02
DAV: 24 -0.382716855882E+03 -0.20988E-02 -0.17805E-04 309 0.248E-02 0.254E-02
DAV: 25 -0.382717277008E+03 -0.42113E-03 -0.25394E-05 264 0.123E-02 0.137E-02
DAV: 26 -0.382717796444E+03 -0.51944E-03 -0.22145E-05 219 0.926E-03 0.438E-03
DAV: 27 -0.382718163534E+03 -0.36709E-03 -0.13160E-05 228 0.700E-03 0.376E-03
DAV: 28 -0.382718298206E+03 -0.13467E-03 -0.37121E-06 228 0.417E-03 0.240E-03
DAV: 29 -0.382718396292E+03 -0.98086E-04 -0.37116E-06 192 0.379E-03 0.160E-03
DAV: 30 -0.382718424569E+03 -0.28277E-04 -0.14148E-06 228 0.247E-03 0.266E-03
DAV: 31 -0.382718457104E+03 -0.32535E-04 -0.11812E-06 192 0.196E-03 0.153E-03
DAV: 32 -0.382718466399E+03 -0.92949E-05 -0.49276E-07 228 0.145E-03
1 F= -.38271847E+03 E0= -.38273525E+03 d E =0.503649E-01