./iterations/neb0_image01_iter189_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 0.365459170320E+03 0.36546E+03 -0.14297E+04 624 0.799E+02
DAV: 2 0.315629695153E+01 -0.36230E+03 -0.34932E+03 842 0.196E+02
DAV: 3 -0.955865122408E+02 -0.98743E+02 -0.98393E+02 669 0.116E+02
DAV: 4 -0.100212703728E+03 -0.46262E+01 -0.46154E+01 680 0.287E+01
DAV: 5 -0.100306068078E+03 -0.93364E-01 -0.93313E-01 728 0.363E+00 0.222E+01
DAV: 6 -0.916821267811E+02 0.86239E+01 -0.30990E+01 688 0.299E+01 0.116E+01
DAV: 7 -0.908826237965E+02 0.79950E+00 -0.18318E+00 712 0.639E+00 0.484E+00
DAV: 8 -0.905082113928E+02 0.37441E+00 -0.55072E-01 704 0.429E+00 0.167E+00
DAV: 9 -0.904260655098E+02 0.82146E-01 -0.13130E-01 720 0.168E+00 0.423E-01
DAV: 10 -0.904215565089E+02 0.45090E-02 -0.47242E-02 720 0.124E+00 0.324E-01
DAV: 11 -0.904258089865E+02 -0.42525E-02 -0.85072E-03 608 0.616E-01 0.116E-01
DAV: 12 -0.904289795249E+02 -0.31705E-02 -0.62097E-03 629 0.421E-01 0.131E-01
DAV: 13 -0.904315145606E+02 -0.25350E-02 -0.15872E-03 853 0.307E-01 0.770E-02
DAV: 14 -0.904348146092E+02 -0.33000E-02 -0.16005E-03 639 0.207E-01 0.748E-02
DAV: 15 -0.904362376714E+02 -0.14231E-02 -0.27443E-04 760 0.118E-01 0.563E-02
DAV: 16 -0.904376125033E+02 -0.13748E-02 -0.11762E-03 661 0.212E-01 0.403E-02
DAV: 17 -0.904384250100E+02 -0.81251E-03 -0.15762E-04 709 0.846E-02 0.341E-02
DAV: 18 -0.904387063835E+02 -0.28137E-03 -0.50157E-05 688 0.351E-02 0.240E-02
DAV: 19 -0.904389442103E+02 -0.23783E-03 -0.13043E-04 628 0.699E-02 0.902E-03
DAV: 20 -0.904389697231E+02 -0.25513E-04 -0.18350E-05 600 0.263E-02 0.942E-03
DAV: 21 -0.904390093402E+02 -0.39617E-04 -0.75773E-06 418 0.162E-02 0.807E-03
DAV: 22 -0.904390302259E+02 -0.20886E-04 -0.46210E-06 468 0.170E-02 0.468E-03
DAV: 23 -0.904390357710E+02 -0.55451E-05 -0.94041E-06 488 0.171E-02
1 F= -.90439036E+02 E0= -.90445308E+02 d E =0.188159E-01