./iterations/neb0_image01_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 0.364907422961E+03 0.36491E+03 -0.14287E+04 624 0.799E+02
DAV: 2 0.258073711548E+01 -0.36233E+03 -0.35022E+03 847 0.195E+02
DAV: 3 -0.956569274324E+02 -0.98238E+02 -0.97907E+02 685 0.116E+02
DAV: 4 -0.100046197167E+03 -0.43893E+01 -0.43793E+01 696 0.276E+01
DAV: 5 -0.100134053448E+03 -0.87856E-01 -0.87807E-01 728 0.346E+00 0.221E+01
DAV: 6 -0.915587234256E+02 0.85753E+01 -0.30987E+01 696 0.298E+01 0.116E+01
DAV: 7 -0.907534454657E+02 0.80528E+00 -0.18147E+00 712 0.637E+00 0.482E+00
DAV: 8 -0.903745945640E+02 0.37885E+00 -0.56920E-01 712 0.435E+00 0.167E+00
DAV: 9 -0.902911561934E+02 0.83438E-01 -0.13832E-01 728 0.167E+00 0.437E-01
DAV: 10 -0.902854621012E+02 0.56941E-02 -0.40998E-02 720 0.124E+00 0.307E-01
DAV: 11 -0.902890429233E+02 -0.35808E-02 -0.62163E-03 608 0.446E-01 0.166E-01
DAV: 12 -0.902923361543E+02 -0.32932E-02 -0.66654E-03 621 0.508E-01 0.118E-01
DAV: 13 -0.902954310729E+02 -0.30949E-02 -0.10943E-03 720 0.276E-01 0.769E-02
DAV: 14 -0.902982527241E+02 -0.28217E-02 -0.15660E-03 629 0.188E-01 0.529E-02
DAV: 15 -0.903005879398E+02 -0.23352E-02 -0.43284E-04 805 0.146E-01 0.320E-02
DAV: 16 -0.903016334934E+02 -0.10456E-02 -0.28871E-04 672 0.899E-02 0.289E-02
DAV: 17 -0.903025507017E+02 -0.91721E-03 -0.13804E-04 641 0.675E-02 0.192E-02
DAV: 18 -0.903027972613E+02 -0.24656E-03 -0.88270E-05 688 0.539E-02 0.131E-02
DAV: 19 -0.903029679950E+02 -0.17073E-03 -0.26253E-05 503 0.321E-02 0.610E-03
DAV: 20 -0.903030071646E+02 -0.39170E-04 -0.88890E-06 488 0.158E-02 0.415E-03
DAV: 21 -0.903030367538E+02 -0.29589E-04 -0.28330E-06 423 0.115E-02 0.318E-03
DAV: 22 -0.903030600641E+02 -0.23310E-04 -0.37339E-06 450 0.874E-03 0.317E-03
DAV: 23 -0.903030635433E+02 -0.34792E-05 -0.16063E-06 512 0.116E-02
1 F= -.90303064E+02 E0= -.90309755E+02 d E =0.200750E-01