./iterations/neb0_image09_iter228_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 0.373963325680E+03 0.37396E+03 -0.14280E+04 624 0.799E+02
DAV: 2 0.329441318966E+01 -0.37067E+03 -0.35807E+03 869 0.196E+02
DAV: 3 -0.967168074581E+02 -0.10001E+03 -0.99682E+02 661 0.117E+02
DAV: 4 -0.101249581899E+03 -0.45328E+01 -0.45221E+01 720 0.287E+01
DAV: 5 -0.101338657111E+03 -0.89075E-01 -0.89034E-01 728 0.365E+00 0.227E+01
DAV: 6 -0.926734283420E+02 0.86652E+01 -0.30987E+01 728 0.300E+01 0.119E+01
DAV: 7 -0.918090146849E+02 0.86441E+00 -0.17169E+00 720 0.613E+00 0.479E+00
DAV: 8 -0.914339618001E+02 0.37505E+00 -0.54487E-01 712 0.395E+00 0.162E+00
DAV: 9 -0.913532369187E+02 0.80725E-01 -0.13175E-01 712 0.155E+00 0.422E-01
DAV: 10 -0.913451311014E+02 0.81058E-02 -0.43726E-02 760 0.108E+00 0.299E-01
DAV: 11 -0.913494605532E+02 -0.43295E-02 -0.11565E-02 608 0.559E-01 0.131E-01
DAV: 12 -0.913527271264E+02 -0.32666E-02 -0.28391E-03 623 0.242E-01 0.107E-01
DAV: 13 -0.913561770027E+02 -0.34499E-02 -0.11674E-03 674 0.187E-01 0.430E-02
DAV: 14 -0.913594157101E+02 -0.32387E-02 -0.72231E-04 656 0.144E-01 0.385E-02
DAV: 15 -0.913607081025E+02 -0.12924E-02 -0.13499E-04 760 0.814E-02 0.322E-02
DAV: 16 -0.913622048712E+02 -0.14968E-02 -0.32249E-04 645 0.860E-02 0.170E-02
DAV: 17 -0.913626461082E+02 -0.44124E-03 -0.67416E-05 688 0.551E-02 0.121E-02
DAV: 18 -0.913628881345E+02 -0.24203E-03 -0.41419E-05 565 0.277E-02 0.891E-03
DAV: 19 -0.913629269878E+02 -0.38853E-04 -0.69167E-06 512 0.156E-02 0.421E-03
DAV: 20 -0.913629567541E+02 -0.29766E-04 -0.72222E-06 418 0.167E-02 0.182E-03
DAV: 21 -0.913629684802E+02 -0.11726E-04 -0.21372E-06 472 0.710E-03 0.238E-03
DAV: 22 -0.913629728353E+02 -0.43551E-05 -0.50630E-07 448 0.439E-03
1 F= -.91362973E+02 E0= -.91367708E+02 d E =0.142043E-01