./iterations/neb0_image04_iter190_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 0.363220183846E+03 0.36322E+03 -0.14357E+04 640 0.799E+02
DAV: 2 0.113043767113E+01 -0.36209E+03 -0.34928E+03 861 0.193E+02
DAV: 3 -0.961813163990E+02 -0.97312E+02 -0.97015E+02 685 0.115E+02
DAV: 4 -0.100281379701E+03 -0.41001E+01 -0.40902E+01 696 0.268E+01
DAV: 5 -0.100359114812E+03 -0.77735E-01 -0.77708E-01 728 0.334E+00 0.224E+01
DAV: 6 -0.916484061618E+02 0.87107E+01 -0.31129E+01 690 0.298E+01 0.116E+01
DAV: 7 -0.907847847014E+02 0.86362E+00 -0.17880E+00 704 0.631E+00 0.483E+00
DAV: 8 -0.903750288684E+02 0.40976E+00 -0.56519E-01 712 0.426E+00 0.165E+00
DAV: 9 -0.902807947607E+02 0.94234E-01 -0.12424E-01 720 0.192E+00 0.483E-01
DAV: 10 -0.902711465066E+02 0.96483E-02 -0.29945E-02 709 0.884E-01 0.332E-01
DAV: 11 -0.902732274301E+02 -0.20809E-02 -0.12328E-02 656 0.681E-01 0.246E-01
DAV: 12 -0.902750461581E+02 -0.18187E-02 -0.32288E-03 768 0.564E-01 0.121E-01
DAV: 13 -0.902793137827E+02 -0.42676E-02 -0.28708E-03 617 0.308E-01 0.961E-02
DAV: 14 -0.902829560815E+02 -0.36423E-02 -0.10054E-03 645 0.166E-01 0.422E-02
DAV: 15 -0.902858940124E+02 -0.29379E-02 -0.54575E-04 661 0.114E-01 0.322E-02
DAV: 16 -0.902880981570E+02 -0.22041E-02 -0.28657E-04 712 0.110E-01 0.194E-02
DAV: 17 -0.902890753501E+02 -0.97719E-03 -0.11281E-04 666 0.515E-02 0.160E-02
DAV: 18 -0.902895168522E+02 -0.44150E-03 -0.12634E-04 736 0.754E-02 0.142E-02
DAV: 19 -0.902897091812E+02 -0.19233E-03 -0.29528E-05 572 0.298E-02 0.124E-02
DAV: 20 -0.902897580065E+02 -0.48825E-04 -0.11476E-05 528 0.207E-02 0.631E-03
DAV: 21 -0.902898264064E+02 -0.68400E-04 -0.17285E-05 435 0.240E-02 0.288E-03
DAV: 22 -0.902898475839E+02 -0.21177E-04 -0.44443E-06 472 0.994E-03 0.361E-03
DAV: 23 -0.902898501162E+02 -0.25323E-05 -0.82405E-07 528 0.529E-03
1 F= -.90289850E+02 E0= -.90298314E+02 d E =0.253912E-01