./iterations/neb0_image02_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 0.363709575423E+03 0.36371E+03 -0.14327E+04 632 0.799E+02
DAV: 2 0.281449645297E+01 -0.36090E+03 -0.34766E+03 845 0.195E+02
DAV: 3 -0.955979966622E+02 -0.98412E+02 -0.98077E+02 664 0.116E+02
DAV: 4 -0.100200297999E+03 -0.46023E+01 -0.45908E+01 720 0.286E+01
DAV: 5 -0.100290474472E+03 -0.90176E-01 -0.90143E-01 736 0.360E+00 0.222E+01
DAV: 6 -0.916639059482E+02 0.86266E+01 -0.31058E+01 688 0.299E+01 0.117E+01
DAV: 7 -0.908561007459E+02 0.80781E+00 -0.18507E+00 704 0.638E+00 0.484E+00
DAV: 8 -0.904746448294E+02 0.38146E+00 -0.55647E-01 704 0.430E+00 0.169E+00
DAV: 9 -0.903866500227E+02 0.87995E-01 -0.13767E-01 696 0.167E+00 0.431E-01
DAV: 10 -0.903807229658E+02 0.59271E-02 -0.50632E-02 704 0.131E+00 0.331E-01
DAV: 11 -0.903842485583E+02 -0.35256E-02 -0.77381E-03 608 0.541E-01 0.139E-01
DAV: 12 -0.903876149503E+02 -0.33664E-02 -0.80092E-03 640 0.483E-01 0.140E-01
DAV: 13 -0.903900766089E+02 -0.24617E-02 -0.19802E-03 901 0.361E-01 0.831E-02
DAV: 14 -0.903932460357E+02 -0.31694E-02 -0.14926E-03 645 0.186E-01 0.682E-02
DAV: 15 -0.903952900237E+02 -0.20440E-02 -0.37587E-04 677 0.109E-01 0.538E-02
DAV: 16 -0.903967656302E+02 -0.14756E-02 -0.99018E-04 664 0.187E-01 0.370E-02
DAV: 17 -0.903976047699E+02 -0.83914E-03 -0.15568E-04 664 0.841E-02 0.284E-02
DAV: 18 -0.903978524345E+02 -0.24766E-03 -0.76597E-05 688 0.423E-02 0.127E-02
DAV: 19 -0.903980539830E+02 -0.20155E-03 -0.57686E-05 623 0.396E-02 0.775E-03
DAV: 20 -0.903980746666E+02 -0.20684E-04 -0.70076E-06 480 0.215E-02 0.722E-03
DAV: 21 -0.903980951009E+02 -0.20434E-04 -0.65293E-06 466 0.145E-02 0.684E-03
DAV: 22 -0.903981258166E+02 -0.30716E-04 -0.51383E-06 420 0.159E-02 0.333E-03
DAV: 23 -0.903981305362E+02 -0.47196E-05 -0.87050E-06 488 0.163E-02
1 F= -.90398131E+02 E0= -.90403918E+02 d E =0.173638E-01