./iterations/neb0_image05_iter216_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 0.369278828418E+03 0.36928E+03 -0.14310E+04 624 0.799E+02
DAV: 2 0.414741600303E+01 -0.36513E+03 -0.35096E+03 848 0.195E+02
DAV: 3 -0.956935126353E+02 -0.99841E+02 -0.99503E+02 677 0.117E+02
DAV: 4 -0.100153822216E+03 -0.44603E+01 -0.44501E+01 712 0.282E+01
DAV: 5 -0.100239692843E+03 -0.85871E-01 -0.85836E-01 725 0.350E+00 0.223E+01
DAV: 6 -0.916213054724E+02 0.86184E+01 -0.31019E+01 680 0.300E+01 0.117E+01
DAV: 7 -0.907863251906E+02 0.83498E+00 -0.17453E+00 728 0.624E+00 0.483E+00
DAV: 8 -0.904073053145E+02 0.37902E+00 -0.54676E-01 728 0.425E+00 0.164E+00
DAV: 9 -0.903242640064E+02 0.83041E-01 -0.13394E-01 720 0.169E+00 0.436E-01
DAV: 10 -0.903176520976E+02 0.66119E-02 -0.46524E-02 773 0.128E+00 0.322E-01
DAV: 11 -0.903207133428E+02 -0.30612E-02 -0.74026E-03 616 0.558E-01 0.139E-01
DAV: 12 -0.903233388259E+02 -0.26255E-02 -0.67599E-03 610 0.481E-01 0.122E-01
DAV: 13 -0.903262440188E+02 -0.29052E-02 -0.15237E-03 864 0.297E-01 0.822E-02
DAV: 14 -0.903294127816E+02 -0.31688E-02 -0.13866E-03 644 0.161E-01 0.577E-02
DAV: 15 -0.903317553542E+02 -0.23426E-02 -0.41557E-04 704 0.119E-01 0.418E-02
DAV: 16 -0.903336853449E+02 -0.19300E-02 -0.86566E-04 661 0.169E-01 0.399E-02
DAV: 17 -0.903343797197E+02 -0.69437E-03 -0.15515E-04 840 0.890E-02 0.242E-02
DAV: 18 -0.903345137547E+02 -0.13403E-03 -0.50112E-05 693 0.373E-02 0.121E-02
DAV: 19 -0.903348406433E+02 -0.32689E-03 -0.70301E-05 636 0.445E-02 0.826E-03
DAV: 20 -0.903348849960E+02 -0.44353E-04 -0.63013E-06 504 0.163E-02 0.640E-03
DAV: 21 -0.903349269656E+02 -0.41970E-04 -0.89545E-06 418 0.166E-02 0.421E-03
DAV: 22 -0.903349433447E+02 -0.16379E-04 -0.39351E-06 488 0.100E-02 0.306E-03
DAV: 23 -0.903349462413E+02 -0.28966E-05 -0.19938E-06 442 0.854E-03
1 F= -.90334946E+02 E0= -.90339768E+02 d E =0.144641E-01