./iterations/neb0_image01_iter212_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 0.365704905331E+03 0.36570E+03 -0.14300E+04 624 0.799E+02
DAV: 2 0.323424415284E+01 -0.36247E+03 -0.34943E+03 839 0.196E+02
DAV: 3 -0.954358438501E+02 -0.98670E+02 -0.98326E+02 645 0.116E+02
DAV: 4 -0.100231989546E+03 -0.47961E+01 -0.47844E+01 704 0.297E+01
DAV: 5 -0.100327663974E+03 -0.95674E-01 -0.95624E-01 728 0.376E+00 0.222E+01
DAV: 6 -0.916953564943E+02 0.86323E+01 -0.30891E+01 688 0.299E+01 0.117E+01
DAV: 7 -0.908868671834E+02 0.80849E+00 -0.18299E+00 712 0.638E+00 0.484E+00
DAV: 8 -0.905107028693E+02 0.37616E+00 -0.55390E-01 704 0.430E+00 0.167E+00
DAV: 9 -0.904284964109E+02 0.82206E-01 -0.13183E-01 720 0.166E+00 0.423E-01
DAV: 10 -0.904239997961E+02 0.44966E-02 -0.47563E-02 712 0.124E+00 0.324E-01
DAV: 11 -0.904281512070E+02 -0.41514E-02 -0.80692E-03 608 0.592E-01 0.118E-01
DAV: 12 -0.904315018576E+02 -0.33507E-02 -0.65410E-03 629 0.440E-01 0.134E-01
DAV: 13 -0.904339543656E+02 -0.24525E-02 -0.16871E-03 853 0.313E-01 0.762E-02
DAV: 14 -0.904371603481E+02 -0.32060E-02 -0.15119E-03 642 0.197E-01 0.725E-02
DAV: 15 -0.904387371703E+02 -0.15768E-02 -0.28545E-04 688 0.113E-01 0.568E-02
DAV: 16 -0.904401338219E+02 -0.13967E-02 -0.11596E-03 661 0.210E-01 0.395E-02
DAV: 17 -0.904409337285E+02 -0.79991E-03 -0.14659E-04 661 0.850E-02 0.332E-02
DAV: 18 -0.904412614193E+02 -0.32769E-03 -0.87305E-05 688 0.462E-02 0.181E-02
DAV: 19 -0.904414439962E+02 -0.18258E-03 -0.93922E-05 645 0.534E-02 0.984E-03
DAV: 20 -0.904414696986E+02 -0.25702E-04 -0.83285E-06 520 0.194E-02 0.872E-03
DAV: 21 -0.904415126373E+02 -0.42939E-04 -0.82054E-06 404 0.152E-02 0.609E-03
DAV: 22 -0.904415232445E+02 -0.10607E-04 -0.39470E-06 480 0.141E-02 0.298E-03
DAV: 23 -0.904415276332E+02 -0.43887E-05 -0.52724E-06 458 0.136E-02
1 F= -.90441528E+02 E0= -.90447650E+02 d E =0.183676E-01