./iterations/neb0_image09_iter208_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 0.373962720192E+03 0.37396E+03 -0.14280E+04 624 0.799E+02
DAV: 2 0.324959757451E+01 -0.37071E+03 -0.35807E+03 869 0.196E+02
DAV: 3 -0.967247113003E+02 -0.99974E+02 -0.99644E+02 661 0.117E+02
DAV: 4 -0.101257698661E+03 -0.45330E+01 -0.45224E+01 720 0.287E+01
DAV: 5 -0.101346572753E+03 -0.88874E-01 -0.88833E-01 720 0.365E+00 0.227E+01
DAV: 6 -0.926768594441E+02 0.86697E+01 -0.31001E+01 725 0.301E+01 0.119E+01
DAV: 7 -0.918104043307E+02 0.86646E+00 -0.17200E+00 720 0.613E+00 0.479E+00
DAV: 8 -0.914350150714E+02 0.37539E+00 -0.54319E-01 712 0.395E+00 0.163E+00
DAV: 9 -0.913537543678E+02 0.81261E-01 -0.13133E-01 712 0.155E+00 0.423E-01
DAV: 10 -0.913455390091E+02 0.82154E-02 -0.44175E-02 776 0.110E+00 0.299E-01
DAV: 11 -0.913499145038E+02 -0.43755E-02 -0.11833E-02 608 0.567E-01 0.132E-01
DAV: 12 -0.913531264808E+02 -0.32120E-02 -0.28472E-03 623 0.244E-01 0.109E-01
DAV: 13 -0.913566442430E+02 -0.35178E-02 -0.13219E-03 679 0.198E-01 0.431E-02
DAV: 14 -0.913599198768E+02 -0.32756E-02 -0.67384E-04 664 0.146E-01 0.356E-02
DAV: 15 -0.913612114723E+02 -0.12916E-02 -0.13084E-04 736 0.782E-02 0.332E-02
DAV: 16 -0.913626620615E+02 -0.14506E-02 -0.33498E-04 656 0.924E-02 0.178E-02
DAV: 17 -0.913630544457E+02 -0.39238E-03 -0.66225E-05 704 0.589E-02 0.122E-02
DAV: 18 -0.913632896015E+02 -0.23516E-03 -0.37019E-05 576 0.267E-02 0.920E-03
DAV: 19 -0.913633684900E+02 -0.78888E-04 -0.93446E-06 480 0.163E-02 0.417E-03
DAV: 20 -0.913634021357E+02 -0.33646E-04 -0.80359E-06 440 0.181E-02 0.197E-03
DAV: 21 -0.913634172194E+02 -0.15084E-04 -0.28771E-06 448 0.792E-03 0.254E-03
DAV: 22 -0.913634214901E+02 -0.42707E-05 -0.68617E-07 477 0.457E-03
1 F= -.91363421E+02 E0= -.91368223E+02 d E =0.144054E-01