./iterations/neb0_image06_iter298_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 0.375587900675E+03 0.37559E+03 -0.14333E+04 632 0.799E+02
DAV: 2 0.479466443636E+01 -0.37079E+03 -0.35880E+03 874 0.195E+02
DAV: 3 -0.943217970841E+02 -0.99116E+02 -0.98722E+02 656 0.116E+02
DAV: 4 -0.989236035536E+02 -0.46018E+01 -0.45830E+01 712 0.290E+01
DAV: 5 -0.990175650535E+02 -0.93961E-01 -0.93905E-01 728 0.376E+00 0.222E+01
DAV: 6 -0.906713381223E+02 0.83462E+01 -0.29641E+01 693 0.303E+01 0.116E+01
DAV: 7 -0.898567184266E+02 0.81462E+00 -0.17259E+00 720 0.645E+00 0.481E+00
DAV: 8 -0.894608493068E+02 0.39587E+00 -0.57905E-01 712 0.424E+00 0.161E+00
DAV: 9 -0.893660248598E+02 0.94824E-01 -0.13044E-01 720 0.168E+00 0.445E-01
DAV: 10 -0.893549643319E+02 0.11061E-01 -0.33901E-02 712 0.931E-01 0.296E-01
DAV: 11 -0.893576667363E+02 -0.27024E-02 -0.11359E-02 616 0.608E-01 0.173E-01
DAV: 12 -0.893591513512E+02 -0.14846E-02 -0.32641E-03 760 0.412E-01 0.103E-01
DAV: 13 -0.893637476290E+02 -0.45963E-02 -0.38219E-03 623 0.320E-01 0.109E-01
DAV: 14 -0.893661736553E+02 -0.24260E-02 -0.11322E-03 808 0.237E-01 0.362E-02
DAV: 15 -0.893694836409E+02 -0.33100E-02 -0.64834E-04 628 0.133E-01 0.373E-02
DAV: 16 -0.893716918356E+02 -0.22082E-02 -0.17719E-04 696 0.670E-02 0.237E-02
DAV: 17 -0.893730665912E+02 -0.13748E-02 -0.31576E-04 652 0.926E-02 0.197E-02
DAV: 18 -0.893733450156E+02 -0.27842E-03 -0.23220E-05 568 0.322E-02 0.146E-02
DAV: 19 -0.893735155688E+02 -0.17055E-03 -0.56478E-05 626 0.427E-02 0.461E-03
DAV: 20 -0.893735611840E+02 -0.45615E-04 -0.47158E-06 496 0.139E-02 0.381E-03
DAV: 21 -0.893736010816E+02 -0.39898E-04 -0.46006E-06 404 0.101E-02 0.251E-03
DAV: 22 -0.893736161672E+02 -0.15086E-04 -0.23862E-06 472 0.869E-03 0.875E-04
DAV: 23 -0.893736211590E+02 -0.49918E-05 -0.10332E-06 428 0.506E-03
1 F= -.89373621E+02 E0= -.89381597E+02 d E =0.239287E-01