./iterations/neb0_image09_iter266_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 0.374198877248E+03 0.37420E+03 -0.14282E+04 624 0.799E+02
DAV: 2 0.331485014999E+01 -0.37088E+03 -0.35821E+03 869 0.196E+02
DAV: 3 -0.968658250548E+02 -0.10018E+03 -0.99856E+02 669 0.117E+02
DAV: 4 -0.101300329043E+03 -0.44345E+01 -0.44242E+01 720 0.283E+01
DAV: 5 -0.101386264423E+03 -0.85935E-01 -0.85899E-01 728 0.358E+00 0.227E+01
DAV: 6 -0.926843872699E+02 0.87019E+01 -0.31052E+01 728 0.301E+01 0.119E+01
DAV: 7 -0.918114176038E+02 0.87297E+00 -0.17292E+00 720 0.614E+00 0.480E+00
DAV: 8 -0.914351088006E+02 0.37631E+00 -0.54267E-01 712 0.394E+00 0.163E+00
DAV: 9 -0.913541328518E+02 0.80976E-01 -0.13265E-01 712 0.155E+00 0.423E-01
DAV: 10 -0.913459611568E+02 0.81717E-02 -0.45111E-02 760 0.109E+00 0.303E-01
DAV: 11 -0.913504913240E+02 -0.45302E-02 -0.12958E-02 608 0.594E-01 0.139E-01
DAV: 12 -0.913536021902E+02 -0.31109E-02 -0.29126E-03 623 0.236E-01 0.113E-01
DAV: 13 -0.913571437135E+02 -0.35415E-02 -0.17365E-03 725 0.224E-01 0.416E-02
DAV: 14 -0.913604813136E+02 -0.33376E-02 -0.54544E-04 656 0.126E-01 0.309E-02
DAV: 15 -0.913619178907E+02 -0.14366E-02 -0.13714E-04 672 0.702E-02 0.308E-02
DAV: 16 -0.913631962544E+02 -0.12784E-02 -0.32040E-04 645 0.896E-02 0.203E-02
DAV: 17 -0.913633968655E+02 -0.20061E-03 -0.42119E-05 640 0.491E-02 0.120E-02
DAV: 18 -0.913636708033E+02 -0.27394E-03 -0.57188E-05 626 0.353E-02 0.102E-02
DAV: 19 -0.913637387458E+02 -0.67943E-04 -0.68540E-06 480 0.192E-02 0.496E-03
DAV: 20 -0.913637728972E+02 -0.34151E-04 -0.17475E-05 440 0.248E-02 0.442E-03
DAV: 21 -0.913637839903E+02 -0.11093E-04 -0.25882E-06 488 0.110E-02 0.306E-03
DAV: 22 -0.913637901083E+02 -0.61180E-05 -0.35834E-06 421 0.118E-02
1 F= -.91363790E+02 E0= -.91368588E+02 d E =0.143950E-01