./iterations/neb0_image06_iter292_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 0.375396057195E+03 0.37540E+03 -0.14330E+04 632 0.799E+02
DAV: 2 0.547610132204E+01 -0.36992E+03 -0.35746E+03 869 0.195E+02
DAV: 3 -0.941738418284E+02 -0.99650E+02 -0.99239E+02 648 0.116E+02
DAV: 4 -0.989709918029E+02 -0.47971E+01 -0.47769E+01 720 0.296E+01
DAV: 5 -0.990685996966E+02 -0.97608E-01 -0.97555E-01 720 0.382E+00 0.222E+01
DAV: 6 -0.906770045916E+02 0.83916E+01 -0.29747E+01 696 0.303E+01 0.116E+01
DAV: 7 -0.898469856030E+02 0.83002E+00 -0.16769E+00 712 0.639E+00 0.483E+00
DAV: 8 -0.894501064393E+02 0.39688E+00 -0.59372E-01 704 0.428E+00 0.159E+00
DAV: 9 -0.893602026557E+02 0.89904E-01 -0.12765E-01 720 0.163E+00 0.441E-01
DAV: 10 -0.893493817733E+02 0.10821E-01 -0.38836E-02 712 0.983E-01 0.303E-01
DAV: 11 -0.893527576234E+02 -0.33759E-02 -0.10492E-02 608 0.562E-01 0.160E-01
DAV: 12 -0.893545193334E+02 -0.17617E-02 -0.28457E-03 680 0.347E-01 0.928E-02
DAV: 13 -0.893591031616E+02 -0.45838E-02 -0.28926E-03 612 0.272E-01 0.904E-02
DAV: 14 -0.893614952151E+02 -0.23921E-02 -0.92889E-04 880 0.246E-01 0.355E-02
DAV: 15 -0.893644436701E+02 -0.29485E-02 -0.55451E-04 626 0.118E-01 0.366E-02
DAV: 16 -0.893664521754E+02 -0.20085E-02 -0.21331E-04 693 0.774E-02 0.202E-02
DAV: 17 -0.893676244246E+02 -0.11722E-02 -0.26417E-04 677 0.824E-02 0.202E-02
DAV: 18 -0.893679857290E+02 -0.36130E-03 -0.68156E-05 656 0.557E-02 0.629E-03
DAV: 19 -0.893680218394E+02 -0.36110E-04 -0.14168E-05 544 0.217E-02 0.341E-03
DAV: 20 -0.893680995618E+02 -0.77722E-04 -0.89946E-06 412 0.170E-02 0.212E-03
DAV: 21 -0.893681228025E+02 -0.23241E-04 -0.31820E-06 480 0.749E-03 0.249E-03
DAV: 22 -0.893681301963E+02 -0.73939E-05 -0.10757E-06 480 0.754E-03
1 F= -.89368130E+02 E0= -.89374343E+02 d E =0.186391E-01