./iterations/neb0_image07_iter293_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 0.373242887736E+03 0.37324E+03 -0.14329E+04 632 0.799E+02
DAV: 2 0.423542045330E+01 -0.36901E+03 -0.35813E+03 858 0.195E+02
DAV: 3 -0.963671876312E+02 -0.10060E+03 -0.10027E+03 648 0.117E+02
DAV: 4 -0.101264167004E+03 -0.48970E+01 -0.48842E+01 720 0.299E+01
DAV: 5 -0.101361151763E+03 -0.96985E-01 -0.96943E-01 728 0.379E+00 0.229E+01
DAV: 6 -0.926301395587E+02 0.87310E+01 -0.31011E+01 714 0.301E+01 0.120E+01
DAV: 7 -0.917470027701E+02 0.88314E+00 -0.17307E+00 720 0.615E+00 0.479E+00
DAV: 8 -0.913675014687E+02 0.37950E+00 -0.52968E-01 736 0.390E+00 0.163E+00
DAV: 9 -0.912820820235E+02 0.85419E-01 -0.13002E-01 736 0.153E+00 0.424E-01
DAV: 10 -0.912725748569E+02 0.95072E-02 -0.46282E-02 776 0.111E+00 0.303E-01
DAV: 11 -0.912776705595E+02 -0.50957E-02 -0.14934E-02 618 0.643E-01 0.163E-01
DAV: 12 -0.912802151691E+02 -0.25446E-02 -0.28329E-03 623 0.237E-01 0.113E-01
DAV: 13 -0.912844756388E+02 -0.42605E-02 -0.34046E-03 641 0.296E-01 0.663E-02
DAV: 14 -0.912874141636E+02 -0.29385E-02 -0.10552E-03 688 0.197E-01 0.298E-02
DAV: 15 -0.912895226015E+02 -0.21084E-02 -0.29631E-04 658 0.793E-02 0.250E-02
DAV: 16 -0.912904081329E+02 -0.88553E-03 -0.10888E-04 664 0.666E-02 0.168E-02
DAV: 17 -0.912909757064E+02 -0.56757E-03 -0.15448E-04 637 0.605E-02 0.165E-02
DAV: 18 -0.912910772841E+02 -0.10158E-03 -0.19584E-05 648 0.343E-02 0.602E-03
DAV: 19 -0.912911736781E+02 -0.96394E-04 -0.31050E-05 540 0.293E-02 0.590E-03
DAV: 20 -0.912911956396E+02 -0.21962E-04 -0.25640E-06 488 0.108E-02 0.459E-03
DAV: 21 -0.912912053144E+02 -0.96748E-05 -0.26942E-06 434 0.965E-03
1 F= -.91291205E+02 E0= -.91295965E+02 d E =0.142783E-01