./iterations/neb0_image09_iter75_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 0.374936390951E+03 0.37494E+03 -0.14283E+04 624 0.799E+02
DAV: 2 0.257586721625E+01 -0.37236E+03 -0.35999E+03 877 0.196E+02
DAV: 3 -0.967715298910E+02 -0.99347E+02 -0.99010E+02 664 0.117E+02
DAV: 4 -0.101255696827E+03 -0.44842E+01 -0.44749E+01 704 0.285E+01
DAV: 5 -0.101344194071E+03 -0.88497E-01 -0.88460E-01 736 0.361E+00 0.227E+01
DAV: 6 -0.926717625695E+02 0.86724E+01 -0.30869E+01 709 0.301E+01 0.119E+01
DAV: 7 -0.918001512857E+02 0.87161E+00 -0.17273E+00 728 0.616E+00 0.480E+00
DAV: 8 -0.914221519759E+02 0.37800E+00 -0.54387E-01 712 0.396E+00 0.163E+00
DAV: 9 -0.913394280926E+02 0.82724E-01 -0.13144E-01 701 0.155E+00 0.424E-01
DAV: 10 -0.913305081441E+02 0.89199E-02 -0.46435E-02 768 0.113E+00 0.305E-01
DAV: 11 -0.913351186422E+02 -0.46105E-02 -0.13720E-02 605 0.612E-01 0.149E-01
DAV: 12 -0.913380022840E+02 -0.28836E-02 -0.29857E-03 636 0.245E-01 0.117E-01
DAV: 13 -0.913417994436E+02 -0.37972E-02 -0.18191E-03 720 0.231E-01 0.439E-02
DAV: 14 -0.913452415984E+02 -0.34422E-02 -0.58218E-04 661 0.138E-01 0.316E-02
DAV: 15 -0.913467294826E+02 -0.14879E-02 -0.15381E-04 672 0.730E-02 0.347E-02
DAV: 16 -0.913479950537E+02 -0.12656E-02 -0.33688E-04 655 0.976E-02 0.198E-02
DAV: 17 -0.913482883543E+02 -0.29330E-03 -0.44388E-05 688 0.513E-02 0.133E-02
DAV: 18 -0.913485056419E+02 -0.21729E-03 -0.47314E-05 637 0.356E-02 0.123E-02
DAV: 19 -0.913486325722E+02 -0.12693E-03 -0.13446E-05 469 0.216E-02 0.512E-03
DAV: 20 -0.913486741305E+02 -0.41558E-04 -0.11697E-05 456 0.177E-02 0.206E-03
DAV: 21 -0.913487010065E+02 -0.26876E-04 -0.37301E-06 414 0.781E-03 0.178E-03
DAV: 22 -0.913487044642E+02 -0.34577E-05 -0.78864E-07 496 0.443E-03
1 F= -.91348704E+02 E0= -.91353615E+02 d E =0.147322E-01