./iterations/neb0_image05_iter146_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 0.364929135556E+03 0.36493E+03 -0.14333E+04 640 0.799E+02
DAV: 2 0.174616907122E+01 -0.36318E+03 -0.35029E+03 869 0.192E+02
DAV: 3 -0.948705167262E+02 -0.96617E+02 -0.96277E+02 645 0.115E+02
DAV: 4 -0.994153627755E+02 -0.45448E+01 -0.45314E+01 728 0.289E+01
DAV: 5 -0.995099724029E+02 -0.94610E-01 -0.94574E-01 736 0.369E+00 0.220E+01
DAV: 6 -0.910181871451E+02 0.84918E+01 -0.30386E+01 677 0.299E+01 0.115E+01
DAV: 7 -0.902521548035E+02 0.76603E+00 -0.18516E+00 728 0.648E+00 0.477E+00
DAV: 8 -0.898778984649E+02 0.37426E+00 -0.50706E-01 712 0.426E+00 0.176E+00
DAV: 9 -0.897847654988E+02 0.93133E-01 -0.14642E-01 725 0.181E+00 0.472E-01
DAV: 10 -0.897757045054E+02 0.90610E-02 -0.33803E-02 736 0.997E-01 0.318E-01
DAV: 11 -0.897772685509E+02 -0.15640E-02 -0.58405E-03 685 0.464E-01 0.160E-01
DAV: 12 -0.897792577470E+02 -0.19892E-02 -0.23835E-03 640 0.371E-01 0.108E-01
DAV: 13 -0.897824292268E+02 -0.31715E-02 -0.14060E-03 609 0.242E-01 0.873E-02
DAV: 14 -0.897868359861E+02 -0.44068E-02 -0.19434E-03 633 0.223E-01 0.495E-02
DAV: 15 -0.897882113628E+02 -0.13754E-02 -0.21034E-04 736 0.976E-02 0.324E-02
DAV: 16 -0.897910814954E+02 -0.28701E-02 -0.71640E-04 748 0.161E-01 0.366E-02
DAV: 17 -0.897913824238E+02 -0.30093E-03 -0.64739E-05 720 0.603E-02 0.302E-02
DAV: 18 -0.897920697162E+02 -0.68729E-03 -0.18917E-04 745 0.850E-02 0.121E-02
DAV: 19 -0.897923923454E+02 -0.32263E-03 -0.62502E-05 680 0.434E-02 0.144E-02
DAV: 20 -0.897925165957E+02 -0.12425E-03 -0.88842E-06 456 0.160E-02 0.111E-02
DAV: 21 -0.897925838148E+02 -0.67219E-04 -0.21494E-05 495 0.304E-02 0.221E-03
DAV: 22 -0.897926207661E+02 -0.36951E-04 -0.93887E-06 450 0.168E-02 0.519E-03
DAV: 23 -0.897926270035E+02 -0.62374E-05 -0.14808E-06 520 0.577E-03
1 F= -.89792627E+02 E0= -.89801954E+02 d E =0.279819E-01