./iterations/neb0_image06_iter254_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 0.373542151057E+03 0.37354E+03 -0.14316E+04 632 0.799E+02
DAV: 2 0.497479164451E+01 -0.36857E+03 -0.35604E+03 858 0.194E+02
DAV: 3 -0.951609961624E+02 -0.10014E+03 -0.99752E+02 680 0.117E+02
DAV: 4 -0.998240038859E+02 -0.46630E+01 -0.46484E+01 736 0.281E+01
DAV: 5 -0.999210313793E+02 -0.97027E-01 -0.96985E-01 720 0.356E+00 0.224E+01
DAV: 6 -0.913953256209E+02 0.85257E+01 -0.30138E+01 688 0.303E+01 0.117E+01
DAV: 7 -0.905784224636E+02 0.81690E+00 -0.17320E+00 720 0.636E+00 0.480E+00
DAV: 8 -0.902051439941E+02 0.37328E+00 -0.55549E-01 696 0.415E+00 0.168E+00
DAV: 9 -0.901145289334E+02 0.90615E-01 -0.12945E-01 720 0.162E+00 0.433E-01
DAV: 10 -0.901047408018E+02 0.97881E-02 -0.33461E-02 760 0.904E-01 0.285E-01
DAV: 11 -0.901086871533E+02 -0.39464E-02 -0.11190E-02 605 0.593E-01 0.173E-01
DAV: 12 -0.901102402745E+02 -0.15531E-02 -0.38806E-03 648 0.383E-01 0.918E-02
DAV: 13 -0.901145825439E+02 -0.43423E-02 -0.26924E-03 617 0.266E-01 0.858E-02
DAV: 14 -0.901167166345E+02 -0.21341E-02 -0.55086E-04 896 0.178E-01 0.357E-02
DAV: 15 -0.901197854841E+02 -0.30688E-02 -0.60390E-04 622 0.127E-01 0.354E-02
DAV: 16 -0.901215626993E+02 -0.17772E-02 -0.23379E-04 882 0.101E-01 0.200E-02
DAV: 17 -0.901224239303E+02 -0.86123E-03 -0.16827E-04 669 0.619E-02 0.168E-02
DAV: 18 -0.901226742895E+02 -0.25036E-03 -0.25822E-05 557 0.315E-02 0.895E-03
DAV: 19 -0.901228041514E+02 -0.12986E-03 -0.39078E-05 642 0.342E-02 0.625E-03
DAV: 20 -0.901228439014E+02 -0.39750E-04 -0.48912E-06 469 0.177E-02 0.289E-03
DAV: 21 -0.901228573154E+02 -0.13414E-04 -0.31103E-06 464 0.835E-03 0.124E-03
DAV: 22 -0.901228662543E+02 -0.89389E-05 -0.13153E-06 415 0.446E-03
1 F= -.90122866E+02 E0= -.90127193E+02 d E =0.129815E-01