./iterations/neb0_image07_iter10_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 0.363713083469E+03 0.36371E+03 -0.14209E+04 624 0.799E+02
DAV: 2 0.233038997304E+01 -0.36138E+03 -0.34930E+03 874 0.194E+02
DAV: 3 -0.950380850853E+02 -0.97368E+02 -0.96956E+02 701 0.114E+02
DAV: 4 -0.992811524226E+02 -0.42431E+01 -0.42269E+01 728 0.267E+01
DAV: 5 -0.993682328400E+02 -0.87080E-01 -0.87048E-01 752 0.340E+00 0.217E+01
DAV: 6 -0.908716128236E+02 0.84966E+01 -0.31489E+01 709 0.307E+01 0.113E+01
DAV: 7 -0.901020081470E+02 0.76960E+00 -0.16741E+00 712 0.689E+00 0.485E+00
DAV: 8 -0.897290942465E+02 0.37291E+00 -0.67454E-01 696 0.451E+00 0.171E+00
DAV: 9 -0.896420040103E+02 0.87090E-01 -0.14863E-01 725 0.190E+00 0.511E-01
DAV: 10 -0.896323061854E+02 0.96978E-02 -0.20015E-02 760 0.711E-01 0.289E-01
DAV: 11 -0.896336131070E+02 -0.13069E-02 -0.14686E-02 621 0.730E-01 0.178E-01
DAV: 12 -0.896355006059E+02 -0.18875E-02 -0.35664E-03 768 0.418E-01 0.108E-01
DAV: 13 -0.896398666488E+02 -0.43660E-02 -0.37147E-03 617 0.329E-01 0.108E-01
DAV: 14 -0.896425840692E+02 -0.27174E-02 -0.14258E-03 658 0.216E-01 0.572E-02
DAV: 15 -0.896454976090E+02 -0.29135E-02 -0.16296E-03 805 0.271E-01 0.625E-02
DAV: 16 -0.896466650983E+02 -0.11675E-02 -0.44882E-04 957 0.152E-01 0.373E-02
DAV: 17 -0.896473420322E+02 -0.67693E-03 -0.26934E-04 658 0.968E-02 0.184E-02
DAV: 18 -0.896480156809E+02 -0.67365E-03 -0.10198E-04 661 0.540E-02 0.145E-02
DAV: 19 -0.896483686414E+02 -0.35296E-03 -0.50015E-05 677 0.434E-02 0.808E-03
DAV: 20 -0.896484730304E+02 -0.10439E-03 -0.22518E-05 485 0.301E-02 0.510E-03
DAV: 21 -0.896485141190E+02 -0.41089E-04 -0.67962E-06 442 0.131E-02 0.391E-03
DAV: 22 -0.896485304055E+02 -0.16287E-04 -0.41018E-06 450 0.125E-02 0.149E-03
DAV: 23 -0.896485388605E+02 -0.84550E-05 -0.17204E-06 434 0.621E-03
1 F= -.89648539E+02 E0= -.89652417E+02 d E =0.116344E-01