./iterations/neb0_image02_iter125_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 0.364744516408E+03 0.36474E+03 -0.14329E+04 632 0.799E+02
DAV: 2 0.397036926464E+01 -0.36077E+03 -0.34626E+03 834 0.195E+02
DAV: 3 -0.955856375154E+02 -0.99556E+02 -0.99223E+02 672 0.116E+02
DAV: 4 -0.100206854088E+03 -0.46212E+01 -0.46101E+01 712 0.286E+01
DAV: 5 -0.100296020465E+03 -0.89166E-01 -0.89127E-01 728 0.357E+00 0.222E+01
DAV: 6 -0.916747594674E+02 0.86213E+01 -0.30923E+01 696 0.299E+01 0.117E+01
DAV: 7 -0.908549424821E+02 0.81982E+00 -0.18439E+00 704 0.636E+00 0.483E+00
DAV: 8 -0.904708608235E+02 0.38408E+00 -0.55713E-01 696 0.428E+00 0.169E+00
DAV: 9 -0.903816681807E+02 0.89193E-01 -0.13960E-01 704 0.166E+00 0.433E-01
DAV: 10 -0.903755444958E+02 0.61237E-02 -0.47763E-02 704 0.130E+00 0.323E-01
DAV: 11 -0.903790846136E+02 -0.35401E-02 -0.70885E-03 608 0.491E-01 0.153E-01
DAV: 12 -0.903824605359E+02 -0.33759E-02 -0.77337E-03 624 0.493E-01 0.134E-01
DAV: 13 -0.903852444153E+02 -0.27839E-02 -0.16331E-03 968 0.339E-01 0.810E-02
DAV: 14 -0.903882535098E+02 -0.30091E-02 -0.13326E-03 640 0.171E-01 0.579E-02
DAV: 15 -0.903905463341E+02 -0.22928E-02 -0.39785E-04 669 0.110E-01 0.433E-02
DAV: 16 -0.903919901124E+02 -0.14438E-02 -0.62354E-04 664 0.142E-01 0.309E-02
DAV: 17 -0.903928500345E+02 -0.85992E-03 -0.14225E-04 661 0.804E-02 0.211E-02
DAV: 18 -0.903930307399E+02 -0.18071E-03 -0.58048E-05 696 0.383E-02 0.978E-03
DAV: 19 -0.903931986776E+02 -0.16794E-03 -0.24563E-05 474 0.262E-02 0.274E-03
DAV: 20 -0.903932555005E+02 -0.56823E-04 -0.64332E-06 472 0.122E-02 0.424E-03
DAV: 21 -0.903932867146E+02 -0.31214E-04 -0.48554E-06 442 0.136E-02 0.473E-03
DAV: 22 -0.903933071597E+02 -0.20445E-04 -0.49048E-06 466 0.122E-02 0.320E-03
DAV: 23 -0.903933091399E+02 -0.19802E-05 -0.29839E-06 528 0.106E-02
1 F= -.90393309E+02 E0= -.90399181E+02 d E =0.176164E-01