./iterations/neb0_image02_iter173_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 0.363691523189E+03 0.36369E+03 -0.14329E+04 632 0.799E+02
DAV: 2 0.189263595886E+01 -0.36180E+03 -0.34989E+03 847 0.195E+02
DAV: 3 -0.956737029362E+02 -0.97566E+02 -0.97237E+02 656 0.115E+02
DAV: 4 -0.100227015743E+03 -0.45533E+01 -0.45426E+01 712 0.288E+01
DAV: 5 -0.100316760465E+03 -0.89745E-01 -0.89713E-01 760 0.363E+00 0.222E+01
DAV: 6 -0.916724406814E+02 0.86443E+01 -0.31066E+01 688 0.300E+01 0.117E+01
DAV: 7 -0.908607580117E+02 0.81168E+00 -0.18454E+00 704 0.637E+00 0.485E+00
DAV: 8 -0.904803478059E+02 0.38041E+00 -0.55487E-01 696 0.431E+00 0.170E+00
DAV: 9 -0.903931295252E+02 0.87218E-01 -0.13723E-01 712 0.167E+00 0.430E-01
DAV: 10 -0.903875910611E+02 0.55385E-02 -0.50151E-02 704 0.129E+00 0.331E-01
DAV: 11 -0.903911283831E+02 -0.35373E-02 -0.77197E-03 616 0.569E-01 0.129E-01
DAV: 12 -0.903943465190E+02 -0.32181E-02 -0.75889E-03 640 0.455E-01 0.140E-01
DAV: 13 -0.903967544898E+02 -0.24080E-02 -0.20359E-03 880 0.357E-01 0.823E-02
DAV: 14 -0.903999401883E+02 -0.31857E-02 -0.14724E-03 642 0.181E-01 0.705E-02
DAV: 15 -0.904018467564E+02 -0.19066E-02 -0.33515E-04 664 0.104E-01 0.554E-02
DAV: 16 -0.904033490919E+02 -0.15023E-02 -0.10965E-03 669 0.196E-01 0.398E-02
DAV: 17 -0.904040767105E+02 -0.72762E-03 -0.15326E-04 720 0.849E-02 0.284E-02
DAV: 18 -0.904044076436E+02 -0.33093E-03 -0.96225E-05 680 0.465E-02 0.107E-02
DAV: 19 -0.904045717117E+02 -0.16407E-03 -0.44488E-05 661 0.341E-02 0.737E-03
DAV: 20 -0.904046019632E+02 -0.30251E-04 -0.40435E-06 520 0.145E-02 0.582E-03
DAV: 21 -0.904046530964E+02 -0.51133E-04 -0.98068E-06 417 0.158E-02 0.331E-03
DAV: 22 -0.904046596738E+02 -0.65774E-05 -0.41269E-06 488 0.118E-02
1 F= -.90404660E+02 E0= -.90411125E+02 d E =0.193953E-01