./iterations/neb0_image06_iter151_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 0.371853770331E+03 0.37185E+03 -0.14349E+04 640 0.799E+02
DAV: 2 0.377742313461E+01 -0.36808E+03 -0.35632E+03 874 0.193E+02
DAV: 3 -0.960760554764E+02 -0.99853E+02 -0.99524E+02 701 0.116E+02
DAV: 4 -0.100475880822E+03 -0.43998E+01 -0.43884E+01 704 0.272E+01
DAV: 5 -0.100561706627E+03 -0.85826E-01 -0.85782E-01 736 0.340E+00 0.227E+01
DAV: 6 -0.919543628306E+02 0.86073E+01 -0.30679E+01 712 0.304E+01 0.119E+01
DAV: 7 -0.911233274533E+02 0.83104E+00 -0.17674E+00 720 0.632E+00 0.481E+00
DAV: 8 -0.907464328314E+02 0.37689E+00 -0.54352E-01 712 0.409E+00 0.168E+00
DAV: 9 -0.906562006497E+02 0.90232E-01 -0.13208E-01 728 0.162E+00 0.423E-01
DAV: 10 -0.906465736978E+02 0.96270E-02 -0.35278E-02 752 0.941E-01 0.282E-01
DAV: 11 -0.906505865037E+02 -0.40128E-02 -0.87880E-03 610 0.506E-01 0.140E-01
DAV: 12 -0.906529816325E+02 -0.23951E-02 -0.17601E-03 645 0.240E-01 0.900E-02
DAV: 13 -0.906573632300E+02 -0.43816E-02 -0.18333E-03 603 0.221E-01 0.674E-02
DAV: 14 -0.906594403077E+02 -0.20771E-02 -0.41005E-04 784 0.139E-01 0.301E-02
DAV: 15 -0.906624110782E+02 -0.29708E-02 -0.48708E-04 609 0.113E-01 0.310E-02
DAV: 16 -0.906637663674E+02 -0.13553E-02 -0.10919E-04 696 0.634E-02 0.160E-02
DAV: 17 -0.906645801725E+02 -0.81381E-03 -0.20868E-04 642 0.803E-02 0.198E-02
DAV: 18 -0.906647639750E+02 -0.18380E-03 -0.35360E-05 584 0.525E-02 0.113E-02
DAV: 19 -0.906648203755E+02 -0.56400E-04 -0.27590E-05 589 0.296E-02 0.660E-03
DAV: 20 -0.906649062093E+02 -0.85834E-04 -0.11410E-05 428 0.187E-02 0.295E-03
DAV: 21 -0.906649407804E+02 -0.34571E-04 -0.51450E-06 453 0.105E-02 0.258E-03
DAV: 22 -0.906649530965E+02 -0.12316E-04 -0.19823E-06 420 0.834E-03 0.131E-03
DAV: 23 -0.906649572150E+02 -0.41185E-05 -0.10425E-06 436 0.487E-03
1 F= -.90664957E+02 E0= -.90671225E+02 d E =0.188030E-01