./iterations/neb0_image09_iter12_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 0.372092207711E+03 0.37209E+03 -0.14266E+04 624 0.799E+02
DAV: 2 0.228720043172E+01 -0.36981E+03 -0.35730E+03 877 0.195E+02
DAV: 3 -0.963463029337E+02 -0.98634E+02 -0.98302E+02 656 0.116E+02
DAV: 4 -0.100906149522E+03 -0.45598E+01 -0.45490E+01 704 0.289E+01
DAV: 5 -0.100997356388E+03 -0.91207E-01 -0.91157E-01 736 0.369E+00 0.224E+01
DAV: 6 -0.924392464405E+02 0.85581E+01 -0.30868E+01 704 0.300E+01 0.117E+01
DAV: 7 -0.916185599768E+02 0.82069E+00 -0.16570E+00 712 0.616E+00 0.477E+00
DAV: 8 -0.912487438409E+02 0.36982E+00 -0.55319E-01 712 0.401E+00 0.161E+00
DAV: 9 -0.911690697990E+02 0.79674E-01 -0.12532E-01 712 0.155E+00 0.417E-01
DAV: 10 -0.911604153667E+02 0.86544E-02 -0.36928E-02 760 0.970E-01 0.284E-01
DAV: 11 -0.911651078065E+02 -0.46924E-02 -0.11721E-02 608 0.583E-01 0.155E-01
DAV: 12 -0.911671104314E+02 -0.20026E-02 -0.19071E-03 664 0.245E-01 0.963E-02
DAV: 13 -0.911716629794E+02 -0.45525E-02 -0.29278E-03 633 0.304E-01 0.669E-02
DAV: 14 -0.911729733125E+02 -0.13103E-02 -0.39109E-04 776 0.158E-01 0.382E-02
DAV: 15 -0.911758947870E+02 -0.29215E-02 -0.84668E-04 663 0.169E-01 0.398E-02
DAV: 16 -0.911766989410E+02 -0.80415E-03 -0.12580E-04 768 0.887E-02 0.212E-02
DAV: 17 -0.911776009781E+02 -0.90204E-03 -0.19251E-04 666 0.795E-02 0.121E-02
DAV: 18 -0.911780359960E+02 -0.43502E-03 -0.43005E-05 672 0.294E-02 0.125E-02
DAV: 19 -0.911781751639E+02 -0.13917E-03 -0.12817E-05 456 0.216E-02 0.670E-03
DAV: 20 -0.911782426202E+02 -0.67456E-04 -0.22036E-05 504 0.255E-02 0.399E-03
DAV: 21 -0.911782600846E+02 -0.17464E-04 -0.33736E-06 466 0.142E-02 0.169E-03
DAV: 22 -0.911782690874E+02 -0.90028E-05 -0.18461E-06 434 0.588E-03
1 F= -.91178269E+02 E0= -.91183093E+02 d E =0.144732E-01