./iterations/neb0_image05_iter21_OSZICAR.out output for 44: 750-->752: Si-OH + Si-H , to Si-O-SI + H2 (TSS)
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.360675001227E+03 0.36068E+03 -0.14244E+04 632 0.799E+02
DAV: 2 0.483624849648E+01 -0.35584E+03 -0.34380E+03 861 0.193E+02
DAV: 3 -0.922422049661E+02 -0.97078E+02 -0.96565E+02 672 0.115E+02
DAV: 4 -0.969113216517E+02 -0.46691E+01 -0.46519E+01 728 0.284E+01
DAV: 5 -0.970120035422E+02 -0.10068E+00 -0.10063E+00 712 0.369E+00 0.211E+01
DAV: 6 -0.888767286097E+02 0.81353E+01 -0.30629E+01 696 0.298E+01 0.109E+01
DAV: 7 -0.881836933062E+02 0.69304E+00 -0.15502E+00 728 0.680E+00 0.469E+00
DAV: 8 -0.878435369225E+02 0.34016E+00 -0.65353E-01 704 0.445E+00 0.168E+00
DAV: 9 -0.877660931240E+02 0.77444E-01 -0.13893E-01 728 0.190E+00 0.481E-01
DAV: 10 -0.877582561759E+02 0.78369E-02 -0.19735E-02 736 0.784E-01 0.295E-01
DAV: 11 -0.877604737268E+02 -0.22176E-02 -0.17246E-02 610 0.839E-01 0.186E-01
DAV: 12 -0.877618157909E+02 -0.13421E-02 -0.32831E-03 728 0.444E-01 0.109E-01
DAV: 13 -0.877661551442E+02 -0.43394E-02 -0.44368E-03 625 0.379E-01 0.107E-01
DAV: 14 -0.877686220498E+02 -0.24669E-02 -0.11697E-03 789 0.225E-01 0.537E-02
DAV: 15 -0.877708954031E+02 -0.22734E-02 -0.13163E-03 725 0.240E-01 0.588E-02
DAV: 16 -0.877722171562E+02 -0.13218E-02 -0.40280E-04 869 0.151E-01 0.305E-02
DAV: 17 -0.877726739798E+02 -0.45682E-03 -0.18151E-04 728 0.803E-02 0.152E-02
DAV: 18 -0.877733951201E+02 -0.72114E-03 -0.91354E-05 641 0.490E-02 0.823E-03
DAV: 19 -0.877737260348E+02 -0.33091E-03 -0.28795E-05 597 0.241E-02 0.585E-03
DAV: 20 -0.877738588343E+02 -0.13280E-03 -0.13552E-05 477 0.200E-02 0.256E-03
DAV: 21 -0.877739111412E+02 -0.52307E-04 -0.88683E-06 439 0.136E-02 0.353E-03
DAV: 22 -0.877739218815E+02 -0.10740E-04 -0.15502E-06 512 0.712E-03 0.231E-03
DAV: 23 -0.877739312628E+02 -0.93813E-05 -0.41258E-06 400 0.133E-02
1 F= -.87773931E+02 E0= -.87777811E+02 d E =0.116397E-01