./iterations/neb0_image07_iter150_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 0.371332745702E+03 0.37133E+03 -0.14316E+04 632 0.799E+02
DAV: 2 0.348859072983E+01 -0.36784E+03 -0.35536E+03 869 0.194E+02
DAV: 3 -0.962047314822E+02 -0.99693E+02 -0.99372E+02 672 0.116E+02
DAV: 4 -0.100961440721E+03 -0.47567E+01 -0.47441E+01 712 0.288E+01
DAV: 5 -0.101059962070E+03 -0.98521E-01 -0.98458E-01 736 0.369E+00 0.226E+01
DAV: 6 -0.924839503770E+02 0.85760E+01 -0.30494E+01 704 0.299E+01 0.118E+01
DAV: 7 -0.916381318355E+02 0.84582E+00 -0.17184E+00 712 0.619E+00 0.478E+00
DAV: 8 -0.912689564322E+02 0.36918E+00 -0.52769E-01 728 0.397E+00 0.165E+00
DAV: 9 -0.911874380221E+02 0.81518E-01 -0.12996E-01 720 0.159E+00 0.424E-01
DAV: 10 -0.911787679656E+02 0.86701E-02 -0.36075E-02 762 0.101E+00 0.280E-01
DAV: 11 -0.911827089989E+02 -0.39410E-02 -0.94004E-03 605 0.519E-01 0.131E-01
DAV: 12 -0.911853578814E+02 -0.26489E-02 -0.20318E-03 641 0.272E-01 0.836E-02
DAV: 13 -0.911892087885E+02 -0.38509E-02 -0.15823E-03 636 0.193E-01 0.664E-02
DAV: 14 -0.911915817325E+02 -0.23729E-02 -0.52228E-04 872 0.189E-01 0.330E-02
DAV: 15 -0.911937787889E+02 -0.21971E-02 -0.34431E-04 644 0.955E-02 0.313E-02
DAV: 16 -0.911951928535E+02 -0.14141E-02 -0.16918E-04 725 0.694E-02 0.239E-02
DAV: 17 -0.911960630210E+02 -0.87017E-03 -0.21054E-04 658 0.733E-02 0.156E-02
DAV: 18 -0.911962792557E+02 -0.21623E-03 -0.32523E-05 624 0.332E-02 0.673E-03
DAV: 19 -0.911964175260E+02 -0.13827E-03 -0.23692E-05 535 0.217E-02 0.376E-03
DAV: 20 -0.911964339743E+02 -0.16448E-04 -0.15906E-06 520 0.908E-03 0.195E-03
DAV: 21 -0.911964643331E+02 -0.30359E-04 -0.55451E-06 392 0.120E-02 0.228E-03
DAV: 22 -0.911964689301E+02 -0.45970E-05 -0.10223E-06 469 0.736E-03
1 F= -.91196469E+02 E0= -.91202506E+02 d E =0.181103E-01