./iterations/neb0_image09_iter178_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 0.374034850725E+03 0.37403E+03 -0.14281E+04 624 0.799E+02
DAV: 2 0.321582363438E+01 -0.37082E+03 -0.35808E+03 869 0.196E+02
DAV: 3 -0.967215561501E+02 -0.99937E+02 -0.99606E+02 661 0.117E+02
DAV: 4 -0.101253227714E+03 -0.45317E+01 -0.45212E+01 720 0.287E+01
DAV: 5 -0.101342142453E+03 -0.88915E-01 -0.88874E-01 728 0.365E+00 0.227E+01
DAV: 6 -0.926793611368E+02 0.86628E+01 -0.30949E+01 717 0.301E+01 0.119E+01
DAV: 7 -0.918095698990E+02 0.86979E+00 -0.17140E+00 728 0.613E+00 0.480E+00
DAV: 8 -0.914332846081E+02 0.37629E+00 -0.54654E-01 712 0.396E+00 0.163E+00
DAV: 9 -0.913519175011E+02 0.81367E-01 -0.13086E-01 712 0.155E+00 0.424E-01
DAV: 10 -0.913435466309E+02 0.83709E-02 -0.43881E-02 760 0.110E+00 0.299E-01
DAV: 11 -0.913479063405E+02 -0.43597E-02 -0.11723E-02 616 0.562E-01 0.133E-01
DAV: 12 -0.913511453102E+02 -0.32390E-02 -0.28909E-03 631 0.247E-01 0.110E-01
DAV: 13 -0.913546191013E+02 -0.34738E-02 -0.12199E-03 677 0.195E-01 0.431E-02
DAV: 14 -0.913577624881E+02 -0.31434E-02 -0.67105E-04 664 0.140E-01 0.371E-02
DAV: 15 -0.913592694629E+02 -0.15070E-02 -0.14870E-04 736 0.810E-02 0.328E-02
DAV: 16 -0.913607338702E+02 -0.14644E-02 -0.31571E-04 648 0.851E-02 0.166E-02
DAV: 17 -0.913611799885E+02 -0.44612E-03 -0.72126E-05 744 0.565E-02 0.125E-02
DAV: 18 -0.913614035936E+02 -0.22361E-03 -0.34461E-05 568 0.255E-02 0.917E-03
DAV: 19 -0.913614523669E+02 -0.48773E-04 -0.86573E-06 504 0.167E-02 0.417E-03
DAV: 20 -0.913614825979E+02 -0.30231E-04 -0.74447E-06 421 0.170E-02 0.204E-03
DAV: 21 -0.913614970329E+02 -0.14435E-04 -0.21993E-06 461 0.723E-03 0.215E-03
DAV: 22 -0.913615021020E+02 -0.50691E-05 -0.82009E-07 440 0.579E-03
1 F= -.91361502E+02 E0= -.91366279E+02 d E =0.143294E-01