./iterations/neb0_image01_iter286_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 0.362839089120E+03 0.36284E+03 -0.14329E+04 632 0.799E+02
DAV: 2 0.302943180533E+01 -0.35981E+03 -0.34753E+03 828 0.195E+02
DAV: 3 -0.956038770920E+02 -0.98633E+02 -0.98293E+02 661 0.115E+02
DAV: 4 -0.100216981519E+03 -0.46131E+01 -0.46005E+01 704 0.287E+01
DAV: 5 -0.100305517264E+03 -0.88536E-01 -0.88494E-01 728 0.361E+00 0.222E+01
DAV: 6 -0.916969848167E+02 0.86085E+01 -0.30933E+01 685 0.299E+01 0.117E+01
DAV: 7 -0.908918155808E+02 0.80517E+00 -0.18493E+00 720 0.638E+00 0.484E+00
DAV: 8 -0.905134491108E+02 0.37837E+00 -0.55251E-01 704 0.429E+00 0.169E+00
DAV: 9 -0.904274386464E+02 0.86010E-01 -0.13668E-01 720 0.165E+00 0.428E-01
DAV: 10 -0.904221378799E+02 0.53008E-02 -0.45477E-02 693 0.125E+00 0.317E-01
DAV: 11 -0.904258366861E+02 -0.36988E-02 -0.64657E-03 608 0.484E-01 0.144E-01
DAV: 12 -0.904293714084E+02 -0.35347E-02 -0.73691E-03 620 0.496E-01 0.132E-01
DAV: 13 -0.904320954876E+02 -0.27241E-02 -0.16795E-03 912 0.327E-01 0.763E-02
DAV: 14 -0.904351463935E+02 -0.30509E-02 -0.12706E-03 642 0.167E-01 0.587E-02
DAV: 15 -0.904372025640E+02 -0.20562E-02 -0.38111E-04 680 0.111E-01 0.444E-02
DAV: 16 -0.904387363777E+02 -0.15338E-02 -0.82079E-04 663 0.166E-01 0.366E-02
DAV: 17 -0.904394423338E+02 -0.70596E-03 -0.13796E-04 736 0.839E-02 0.238E-02
DAV: 18 -0.904396855909E+02 -0.24326E-03 -0.86404E-05 661 0.464E-02 0.845E-03
DAV: 19 -0.904398555530E+02 -0.16996E-03 -0.29758E-05 517 0.270E-02 0.557E-03
DAV: 20 -0.904398937543E+02 -0.38201E-04 -0.46833E-06 488 0.127E-02 0.681E-03
DAV: 21 -0.904399405527E+02 -0.46798E-04 -0.95850E-06 404 0.187E-02 0.379E-03
DAV: 22 -0.904399453067E+02 -0.47540E-05 -0.52661E-06 488 0.137E-02
1 F= -.90439945E+02 E0= -.90446038E+02 d E =0.182769E-01