./iterations/neb0_image07_iter106_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 0.377778835598E+03 0.37778E+03 -0.14286E+04 624 0.799E+02
DAV: 2 0.340395217381E+01 -0.37437E+03 -0.36234E+03 877 0.196E+02
DAV: 3 -0.964304398998E+02 -0.99834E+02 -0.99498E+02 656 0.117E+02
DAV: 4 -0.101026918084E+03 -0.45965E+01 -0.45853E+01 696 0.290E+01
DAV: 5 -0.101118857619E+03 -0.91940E-01 -0.91903E-01 728 0.369E+00 0.228E+01
DAV: 6 -0.924411423860E+02 0.86777E+01 -0.30697E+01 701 0.303E+01 0.120E+01
DAV: 7 -0.915617484697E+02 0.87939E+00 -0.16895E+00 728 0.614E+00 0.482E+00
DAV: 8 -0.911788568831E+02 0.38289E+00 -0.55524E-01 704 0.402E+00 0.163E+00
DAV: 9 -0.910946115507E+02 0.84245E-01 -0.13322E-01 720 0.156E+00 0.426E-01
DAV: 10 -0.910853764182E+02 0.92351E-02 -0.47777E-02 741 0.113E+00 0.310E-01
DAV: 11 -0.910898188908E+02 -0.44425E-02 -0.12335E-02 616 0.584E-01 0.133E-01
DAV: 12 -0.910930897518E+02 -0.32709E-02 -0.35616E-03 605 0.273E-01 0.145E-01
DAV: 13 -0.910969107596E+02 -0.38210E-02 -0.26161E-03 728 0.316E-01 0.548E-02
DAV: 14 -0.910994900555E+02 -0.25793E-02 -0.60641E-04 653 0.114E-01 0.575E-02
DAV: 15 -0.911020978513E+02 -0.26078E-02 -0.32235E-04 637 0.904E-02 0.322E-02
DAV: 16 -0.911030810887E+02 -0.98324E-03 -0.36338E-04 688 0.944E-02 0.294E-02
DAV: 17 -0.911035685613E+02 -0.48747E-03 -0.13383E-04 640 0.745E-02 0.966E-03
DAV: 18 -0.911037381572E+02 -0.16960E-03 -0.24073E-05 560 0.283E-02 0.721E-03
DAV: 19 -0.911038115562E+02 -0.73399E-04 -0.14259E-05 440 0.223E-02 0.206E-03
DAV: 20 -0.911038496829E+02 -0.38127E-04 -0.42319E-06 445 0.101E-02 0.152E-03
DAV: 21 -0.911038660488E+02 -0.16366E-04 -0.19900E-06 437 0.575E-03 0.929E-04
DAV: 22 -0.911038714234E+02 -0.53745E-05 -0.73849E-07 449 0.307E-03
1 F= -.91103871E+02 E0= -.91108535E+02 d E =0.139906E-01