./iterations/neb0_image09_iter95_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 0.374342454920E+03 0.37434E+03 -0.14280E+04 624 0.799E+02
DAV: 2 0.245113689006E+01 -0.37189E+03 -0.35954E+03 877 0.196E+02
DAV: 3 -0.966802133218E+02 -0.99131E+02 -0.98793E+02 656 0.116E+02
DAV: 4 -0.101218250332E+03 -0.45380E+01 -0.45286E+01 696 0.289E+01
DAV: 5 -0.101308244456E+03 -0.89994E-01 -0.89955E-01 736 0.368E+00 0.227E+01
DAV: 6 -0.926672181743E+02 0.86410E+01 -0.30843E+01 701 0.301E+01 0.119E+01
DAV: 7 -0.918014136750E+02 0.86580E+00 -0.17067E+00 728 0.615E+00 0.480E+00
DAV: 8 -0.914241737479E+02 0.37724E+00 -0.54736E-01 712 0.397E+00 0.163E+00
DAV: 9 -0.913419548010E+02 0.82219E-01 -0.13061E-01 704 0.155E+00 0.424E-01
DAV: 10 -0.913329858546E+02 0.89689E-02 -0.45369E-02 752 0.111E+00 0.302E-01
DAV: 11 -0.913375154527E+02 -0.45296E-02 -0.13134E-02 616 0.594E-01 0.148E-01
DAV: 12 -0.913404434313E+02 -0.29280E-02 -0.29507E-03 620 0.244E-01 0.112E-01
DAV: 13 -0.913441911938E+02 -0.37478E-02 -0.15112E-03 672 0.213E-01 0.441E-02
DAV: 14 -0.913475678331E+02 -0.33766E-02 -0.65265E-04 669 0.146E-01 0.340E-02
DAV: 15 -0.913489582982E+02 -0.13905E-02 -0.13720E-04 712 0.721E-02 0.345E-02
DAV: 16 -0.913503649643E+02 -0.14067E-02 -0.35291E-04 647 0.960E-02 0.185E-02
DAV: 17 -0.913507173532E+02 -0.35239E-03 -0.51704E-05 688 0.525E-02 0.124E-02
DAV: 18 -0.913509634863E+02 -0.24613E-03 -0.44946E-05 573 0.319E-02 0.111E-02
DAV: 19 -0.913510481830E+02 -0.84697E-04 -0.10855E-05 480 0.191E-02 0.518E-03
DAV: 20 -0.913510785730E+02 -0.30390E-04 -0.85878E-06 448 0.181E-02 0.181E-03
DAV: 21 -0.913511014473E+02 -0.22874E-04 -0.42497E-06 434 0.102E-02 0.275E-03
DAV: 22 -0.913511080601E+02 -0.66128E-05 -0.10103E-06 448 0.449E-03
1 F= -.91351108E+02 E0= -.91355776E+02 d E =0.140028E-01