./iterations/neb0_image06_iter284_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 0.374778139238E+03 0.37478E+03 -0.14324E+04 632 0.799E+02
DAV: 2 0.608553055090E+01 -0.36869E+03 -0.35622E+03 853 0.194E+02
DAV: 3 -0.944156021726E+02 -0.10050E+03 -0.10009E+03 672 0.117E+02
DAV: 4 -0.990454021598E+02 -0.46298E+01 -0.46113E+01 712 0.287E+01
DAV: 5 -0.991386188529E+02 -0.93217E-01 -0.93162E-01 720 0.366E+00 0.222E+01
DAV: 6 -0.907530855595E+02 0.83855E+01 -0.29742E+01 685 0.302E+01 0.116E+01
DAV: 7 -0.899225062295E+02 0.83058E+00 -0.16457E+00 712 0.633E+00 0.481E+00
DAV: 8 -0.895339099974E+02 0.38860E+00 -0.59218E-01 704 0.423E+00 0.157E+00
DAV: 9 -0.894480479166E+02 0.85862E-01 -0.12150E-01 712 0.159E+00 0.436E-01
DAV: 10 -0.894379036332E+02 0.10144E-01 -0.42804E-02 720 0.102E+00 0.309E-01
DAV: 11 -0.894419948782E+02 -0.40912E-02 -0.11967E-02 608 0.612E-01 0.169E-01
DAV: 12 -0.894432942674E+02 -0.12994E-02 -0.27876E-03 664 0.313E-01 0.966E-02
DAV: 13 -0.894480214798E+02 -0.47272E-02 -0.27267E-03 625 0.267E-01 0.767E-02
DAV: 14 -0.894500976026E+02 -0.20761E-02 -0.60121E-04 760 0.203E-01 0.382E-02
DAV: 15 -0.894532321855E+02 -0.31346E-02 -0.71219E-04 630 0.132E-01 0.345E-02
DAV: 16 -0.894547700552E+02 -0.15379E-02 -0.17596E-04 677 0.785E-02 0.135E-02
DAV: 17 -0.894559181354E+02 -0.11481E-02 -0.22169E-04 682 0.745E-02 0.199E-02
DAV: 18 -0.894562184741E+02 -0.30034E-03 -0.38939E-05 560 0.454E-02 0.919E-03
DAV: 19 -0.894563025369E+02 -0.84063E-04 -0.24870E-05 528 0.270E-02 0.445E-03
DAV: 20 -0.894563854212E+02 -0.82884E-04 -0.11351E-05 423 0.200E-02 0.277E-03
DAV: 21 -0.894564173718E+02 -0.31951E-04 -0.42907E-06 480 0.996E-03 0.293E-03
DAV: 22 -0.894564278463E+02 -0.10475E-04 -0.12216E-06 456 0.735E-03 0.132E-03
DAV: 23 -0.894564372251E+02 -0.93788E-05 -0.25766E-06 409 0.849E-03
1 F= -.89456437E+02 E0= -.89462188E+02 d E =0.172527E-01