./iterations/neb0_image09_iter150_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 0.374511274618E+03 0.37451E+03 -0.14284E+04 624 0.799E+02
DAV: 2 0.328316350614E+01 -0.37123E+03 -0.35838E+03 869 0.196E+02
DAV: 3 -0.968418123963E+02 -0.10012E+03 -0.99795E+02 669 0.117E+02
DAV: 4 -0.101290948220E+03 -0.44491E+01 -0.44388E+01 720 0.283E+01
DAV: 5 -0.101376904473E+03 -0.85956E-01 -0.85917E-01 720 0.358E+00 0.227E+01
DAV: 6 -0.926807793011E+02 0.86961E+01 -0.30988E+01 728 0.301E+01 0.119E+01
DAV: 7 -0.918000656301E+02 0.88071E+00 -0.17261E+00 720 0.613E+00 0.479E+00
DAV: 8 -0.914217426351E+02 0.37832E+00 -0.53972E-01 712 0.393E+00 0.163E+00
DAV: 9 -0.913398506433E+02 0.81892E-01 -0.13399E-01 712 0.157E+00 0.425E-01
DAV: 10 -0.913316420965E+02 0.82085E-02 -0.45516E-02 784 0.113E+00 0.303E-01
DAV: 11 -0.913358149568E+02 -0.41729E-02 -0.12378E-02 616 0.586E-01 0.132E-01
DAV: 12 -0.913389125712E+02 -0.30976E-02 -0.28565E-03 626 0.243E-01 0.115E-01
DAV: 13 -0.913426773648E+02 -0.37648E-02 -0.16042E-03 664 0.220E-01 0.435E-02
DAV: 14 -0.913457359684E+02 -0.30586E-02 -0.55588E-04 664 0.132E-01 0.331E-02
DAV: 15 -0.913474559661E+02 -0.17200E-02 -0.14971E-04 704 0.679E-02 0.340E-02
DAV: 16 -0.913487675161E+02 -0.13115E-02 -0.32342E-04 658 0.894E-02 0.169E-02
DAV: 17 -0.913491587412E+02 -0.39123E-03 -0.41072E-05 672 0.410E-02 0.125E-02
DAV: 18 -0.913494049372E+02 -0.24620E-03 -0.41981E-05 568 0.296E-02 0.851E-03
DAV: 19 -0.913494572079E+02 -0.52271E-04 -0.62016E-06 512 0.171E-02 0.376E-03
DAV: 20 -0.913494868911E+02 -0.29683E-04 -0.69938E-06 418 0.155E-02 0.220E-03
DAV: 21 -0.913495092486E+02 -0.22358E-04 -0.31428E-06 453 0.792E-03 0.263E-03
DAV: 22 -0.913495125548E+02 -0.33062E-05 -0.54623E-07 512 0.461E-03
1 F= -.91349513E+02 E0= -.91354099E+02 d E =0.137596E-01