./iterations/neb0_image07_iter274_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 0.371410363495E+03 0.37141E+03 -0.14321E+04 632 0.799E+02
DAV: 2 0.358634647664E+01 -0.36782E+03 -0.35659E+03 866 0.194E+02
DAV: 3 -0.963197871477E+02 -0.99906E+02 -0.99591E+02 656 0.116E+02
DAV: 4 -0.101164039747E+03 -0.48443E+01 -0.48312E+01 712 0.297E+01
DAV: 5 -0.101261055979E+03 -0.97016E-01 -0.96970E-01 720 0.379E+00 0.227E+01
DAV: 6 -0.926202646704E+02 0.86408E+01 -0.30960E+01 701 0.299E+01 0.119E+01
DAV: 7 -0.917583341290E+02 0.86193E+00 -0.17003E+00 736 0.612E+00 0.480E+00
DAV: 8 -0.913821556126E+02 0.37618E+00 -0.55065E-01 736 0.401E+00 0.161E+00
DAV: 9 -0.913003058340E+02 0.81850E-01 -0.12683E-01 728 0.152E+00 0.422E-01
DAV: 10 -0.912912100593E+02 0.90958E-02 -0.43303E-02 749 0.104E+00 0.295E-01
DAV: 11 -0.912961690784E+02 -0.49590E-02 -0.12794E-02 613 0.579E-01 0.151E-01
DAV: 12 -0.912992523359E+02 -0.30833E-02 -0.28288E-03 615 0.231E-01 0.103E-01
DAV: 13 -0.913031070173E+02 -0.38547E-02 -0.20248E-03 638 0.232E-01 0.494E-02
DAV: 14 -0.913064889717E+02 -0.33820E-02 -0.78627E-04 653 0.174E-01 0.296E-02
DAV: 15 -0.913078030347E+02 -0.13141E-02 -0.18219E-04 672 0.752E-02 0.238E-02
DAV: 16 -0.913087592064E+02 -0.95617E-03 -0.22579E-04 709 0.971E-02 0.167E-02
DAV: 17 -0.913093033350E+02 -0.54413E-03 -0.53800E-05 658 0.384E-02 0.145E-02
DAV: 18 -0.913094522459E+02 -0.14891E-03 -0.22399E-05 520 0.274E-02 0.769E-03
DAV: 19 -0.913096187043E+02 -0.16646E-03 -0.30346E-05 521 0.272E-02 0.402E-03
DAV: 20 -0.913096349063E+02 -0.16202E-04 -0.21663E-06 520 0.931E-03 0.309E-03
DAV: 21 -0.913096555350E+02 -0.20629E-04 -0.36684E-06 418 0.124E-02 0.145E-03
DAV: 22 -0.913096655591E+02 -0.10024E-04 -0.12463E-06 445 0.576E-03 0.916E-04
DAV: 23 -0.913096673927E+02 -0.18337E-05 -0.34070E-07 504 0.269E-03
1 F= -.91309667E+02 E0= -.91314415E+02 d E =0.142430E-01