./iterations/neb0_image05_iter254_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 0.366812006410E+03 0.36681E+03 -0.14296E+04 624 0.799E+02
DAV: 2 0.440569616167E+01 -0.36241E+03 -0.34846E+03 842 0.195E+02
DAV: 3 -0.954604260417E+02 -0.99866E+02 -0.99519E+02 672 0.117E+02
DAV: 4 -0.100094980410E+03 -0.46346E+01 -0.46239E+01 704 0.289E+01
DAV: 5 -0.100185049036E+03 -0.90069E-01 -0.90031E-01 728 0.363E+00 0.221E+01
DAV: 6 -0.915957483955E+02 0.85893E+01 -0.31160E+01 704 0.300E+01 0.116E+01
DAV: 7 -0.907895615837E+02 0.80619E+00 -0.17643E+00 712 0.624E+00 0.481E+00
DAV: 8 -0.904157515643E+02 0.37381E+00 -0.53959E-01 736 0.425E+00 0.168E+00
DAV: 9 -0.903278738619E+02 0.87878E-01 -0.12759E-01 720 0.166E+00 0.431E-01
DAV: 10 -0.903190143134E+02 0.88595E-02 -0.41280E-02 728 0.113E+00 0.323E-01
DAV: 11 -0.903219834591E+02 -0.29691E-02 -0.93508E-03 624 0.813E-01 0.173E-01
DAV: 12 -0.903229286545E+02 -0.94520E-03 -0.40115E-03 672 0.348E-01 0.131E-01
DAV: 13 -0.903255553471E+02 -0.26267E-02 -0.25484E-03 666 0.301E-01 0.884E-02
DAV: 14 -0.903291591584E+02 -0.36038E-02 -0.70851E-04 665 0.149E-01 0.678E-02
DAV: 15 -0.903323585092E+02 -0.31994E-02 -0.74253E-04 644 0.124E-01 0.391E-02
DAV: 16 -0.903341492407E+02 -0.17907E-02 -0.30389E-04 704 0.944E-02 0.281E-02
DAV: 17 -0.903355088308E+02 -0.13596E-02 -0.24223E-04 858 0.111E-01 0.214E-02
DAV: 18 -0.903357572929E+02 -0.24846E-03 -0.10167E-04 712 0.638E-02 0.256E-02
DAV: 19 -0.903360028136E+02 -0.24552E-03 -0.74778E-05 638 0.629E-02 0.649E-03
DAV: 20 -0.903361437396E+02 -0.14093E-03 -0.40090E-05 664 0.354E-02 0.972E-03
DAV: 21 -0.903362445538E+02 -0.10081E-03 -0.10125E-05 427 0.185E-02 0.666E-03
DAV: 22 -0.903362752954E+02 -0.30742E-04 -0.12029E-05 477 0.208E-02 0.258E-03
DAV: 23 -0.903362785706E+02 -0.32752E-05 -0.23758E-06 528 0.925E-03
1 F= -.90336279E+02 E0= -.90344699E+02 d E =0.252613E-01