./iterations/neb0_image05_iter186_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 0.369053769360E+03 0.36905E+03 -0.14297E+04 624 0.799E+02
DAV: 2 0.319786357733E+01 -0.36586E+03 -0.35310E+03 864 0.195E+02
DAV: 3 -0.953790790192E+02 -0.98577E+02 -0.98251E+02 661 0.116E+02
DAV: 4 -0.100001677503E+03 -0.46226E+01 -0.46115E+01 704 0.288E+01
DAV: 5 -0.100095743225E+03 -0.94066E-01 -0.94015E-01 728 0.364E+00 0.221E+01
DAV: 6 -0.915638092811E+02 0.85319E+01 -0.30811E+01 680 0.299E+01 0.116E+01
DAV: 7 -0.907799057557E+02 0.78390E+00 -0.18864E+00 728 0.642E+00 0.483E+00
DAV: 8 -0.904048382441E+02 0.37507E+00 -0.53588E-01 728 0.427E+00 0.170E+00
DAV: 9 -0.903148828195E+02 0.89955E-01 -0.13776E-01 720 0.168E+00 0.431E-01
DAV: 10 -0.903068599620E+02 0.80229E-02 -0.46931E-02 728 0.124E+00 0.318E-01
DAV: 11 -0.903105061515E+02 -0.36462E-02 -0.72459E-03 624 0.529E-01 0.130E-01
DAV: 12 -0.903131549997E+02 -0.26488E-02 -0.60701E-03 610 0.437E-01 0.123E-01
DAV: 13 -0.903157575242E+02 -0.26025E-02 -0.14855E-03 896 0.295E-01 0.735E-02
DAV: 14 -0.903192126198E+02 -0.34551E-02 -0.12327E-03 630 0.152E-01 0.505E-02
DAV: 15 -0.903217413487E+02 -0.25287E-02 -0.36870E-04 712 0.100E-01 0.382E-02
DAV: 16 -0.903233610916E+02 -0.16197E-02 -0.49556E-04 669 0.121E-01 0.274E-02
DAV: 17 -0.903241054524E+02 -0.74436E-03 -0.10297E-04 680 0.662E-02 0.235E-02
DAV: 18 -0.903243192650E+02 -0.21381E-03 -0.97404E-05 680 0.545E-02 0.119E-02
DAV: 19 -0.903244740668E+02 -0.15480E-03 -0.24195E-05 514 0.341E-02 0.432E-03
DAV: 20 -0.903245518650E+02 -0.77798E-04 -0.10230E-05 480 0.153E-02 0.331E-03
DAV: 21 -0.903245798059E+02 -0.27941E-04 -0.39576E-06 448 0.874E-03 0.197E-03
DAV: 22 -0.903245916534E+02 -0.11848E-04 -0.19905E-06 461 0.624E-03 0.128E-03
DAV: 23 -0.903245932595E+02 -0.16061E-05 -0.57384E-07 512 0.331E-03
1 F= -.90324593E+02 E0= -.90332278E+02 d E =0.230527E-01