./iterations/neb0_image07_iter120_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 0.376270206661E+03 0.37627E+03 -0.14278E+04 624 0.799E+02
DAV: 2 0.331689339226E+01 -0.37295E+03 -0.36052E+03 877 0.196E+02
DAV: 3 -0.963644197516E+02 -0.99681E+02 -0.99347E+02 656 0.117E+02
DAV: 4 -0.100995488087E+03 -0.46311E+01 -0.46195E+01 696 0.290E+01
DAV: 5 -0.101089108051E+03 -0.93620E-01 -0.93580E-01 728 0.371E+00 0.227E+01
DAV: 6 -0.924826850024E+02 0.86064E+01 -0.30689E+01 712 0.303E+01 0.119E+01
DAV: 7 -0.916240710170E+02 0.85861E+00 -0.16775E+00 720 0.613E+00 0.480E+00
DAV: 8 -0.912455840469E+02 0.37849E+00 -0.55556E-01 712 0.402E+00 0.163E+00
DAV: 9 -0.911620085145E+02 0.83576E-01 -0.13132E-01 720 0.155E+00 0.425E-01
DAV: 10 -0.911525628810E+02 0.94456E-02 -0.47362E-02 741 0.111E+00 0.308E-01
DAV: 11 -0.911576759955E+02 -0.51131E-02 -0.14555E-02 616 0.631E-01 0.162E-01
DAV: 12 -0.911602979631E+02 -0.26220E-02 -0.30294E-03 650 0.242E-01 0.145E-01
DAV: 13 -0.911643527055E+02 -0.40547E-02 -0.34545E-03 658 0.342E-01 0.627E-02
DAV: 14 -0.911667507452E+02 -0.23980E-02 -0.48890E-04 672 0.115E-01 0.552E-02
DAV: 15 -0.911692769199E+02 -0.25262E-02 -0.36293E-04 629 0.908E-02 0.273E-02
DAV: 16 -0.911701167505E+02 -0.83983E-03 -0.22424E-04 688 0.727E-02 0.240E-02
DAV: 17 -0.911706798662E+02 -0.56312E-03 -0.84384E-05 634 0.530E-02 0.107E-02
DAV: 18 -0.911708279194E+02 -0.14805E-03 -0.16350E-05 496 0.220E-02 0.678E-03
DAV: 19 -0.911708850115E+02 -0.57092E-04 -0.11383E-05 456 0.199E-02 0.251E-03
DAV: 20 -0.911709293925E+02 -0.44381E-04 -0.50351E-06 415 0.102E-02 0.288E-03
DAV: 21 -0.911709449263E+02 -0.15534E-04 -0.18901E-06 453 0.689E-03 0.163E-03
DAV: 22 -0.911709509841E+02 -0.60578E-05 -0.23086E-06 431 0.871E-03
1 F= -.91170951E+02 E0= -.91176329E+02 d E =0.161330E-01