./iterations/neb0_image06_iter98_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 0.374878324695E+03 0.37488E+03 -0.14306E+04 632 0.799E+02
DAV: 2 0.357249781383E+01 -0.37131E+03 -0.35920E+03 877 0.195E+02
DAV: 3 -0.956001792832E+02 -0.99173E+02 -0.98848E+02 656 0.116E+02
DAV: 4 -0.100180890521E+03 -0.45807E+01 -0.45697E+01 704 0.289E+01
DAV: 5 -0.100274916367E+03 -0.94026E-01 -0.93986E-01 744 0.368E+00 0.225E+01
DAV: 6 -0.916757284807E+02 0.85992E+01 -0.30948E+01 698 0.306E+01 0.117E+01
DAV: 7 -0.908523890131E+02 0.82334E+00 -0.17073E+00 720 0.628E+00 0.481E+00
DAV: 8 -0.904710010654E+02 0.38139E+00 -0.53529E-01 712 0.408E+00 0.166E+00
DAV: 9 -0.903799177637E+02 0.91083E-01 -0.13064E-01 728 0.160E+00 0.421E-01
DAV: 10 -0.903696463187E+02 0.10271E-01 -0.47047E-02 720 0.111E+00 0.310E-01
DAV: 11 -0.903742186797E+02 -0.45724E-02 -0.12966E-02 621 0.623E-01 0.164E-01
DAV: 12 -0.903763550369E+02 -0.21364E-02 -0.25118E-03 652 0.250E-01 0.127E-01
DAV: 13 -0.903810543523E+02 -0.46993E-02 -0.35196E-03 650 0.364E-01 0.688E-02
DAV: 14 -0.903828283442E+02 -0.17740E-02 -0.42533E-04 704 0.128E-01 0.513E-02
DAV: 15 -0.903861928319E+02 -0.33645E-02 -0.86350E-04 671 0.167E-01 0.357E-02
DAV: 16 -0.903868798121E+02 -0.68698E-03 -0.13066E-04 741 0.651E-02 0.289E-02
DAV: 17 -0.903873536407E+02 -0.47383E-03 -0.90269E-05 663 0.585E-02 0.132E-02
DAV: 18 -0.903880689639E+02 -0.71532E-03 -0.11243E-04 636 0.474E-02 0.904E-03
DAV: 19 -0.903881318993E+02 -0.62935E-04 -0.57334E-06 536 0.167E-02 0.747E-03
DAV: 20 -0.903882174812E+02 -0.85582E-04 -0.15067E-05 421 0.213E-02 0.571E-03
DAV: 21 -0.903882366659E+02 -0.19185E-04 -0.40494E-06 501 0.125E-02 0.307E-03
DAV: 22 -0.903882543160E+02 -0.17650E-04 -0.51459E-06 403 0.143E-02 0.181E-03
DAV: 23 -0.903882590956E+02 -0.47796E-05 -0.16305E-06 488 0.650E-03
1 F= -.90388259E+02 E0= -.90392524E+02 d E =0.127933E-01