./iterations/neb0_image01_iter294_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 0.363601711360E+03 0.36360E+03 -0.14334E+04 632 0.799E+02
DAV: 2 0.313844503928E+01 -0.36046E+03 -0.34816E+03 828 0.195E+02
DAV: 3 -0.956448990912E+02 -0.98783E+02 -0.98443E+02 661 0.116E+02
DAV: 4 -0.100262893226E+03 -0.46180E+01 -0.46055E+01 696 0.287E+01
DAV: 5 -0.100351374482E+03 -0.88481E-01 -0.88437E-01 728 0.361E+00 0.223E+01
DAV: 6 -0.917139050882E+02 0.86375E+01 -0.30884E+01 685 0.299E+01 0.117E+01
DAV: 7 -0.908927620429E+02 0.82114E+00 -0.18511E+00 720 0.637E+00 0.484E+00
DAV: 8 -0.905118090516E+02 0.38095E+00 -0.55848E-01 696 0.431E+00 0.168E+00
DAV: 9 -0.904261003481E+02 0.85709E-01 -0.13632E-01 712 0.165E+00 0.428E-01
DAV: 10 -0.904207081337E+02 0.53922E-02 -0.45959E-02 701 0.126E+00 0.318E-01
DAV: 11 -0.904244136895E+02 -0.37056E-02 -0.66443E-03 608 0.487E-01 0.143E-01
DAV: 12 -0.904279233356E+02 -0.35096E-02 -0.74596E-03 628 0.498E-01 0.133E-01
DAV: 13 -0.904305638342E+02 -0.26405E-02 -0.16997E-03 888 0.326E-01 0.763E-02
DAV: 14 -0.904336612099E+02 -0.30974E-02 -0.13006E-03 639 0.168E-01 0.575E-02
DAV: 15 -0.904357500975E+02 -0.20889E-02 -0.35648E-04 680 0.106E-01 0.445E-02
DAV: 16 -0.904373467858E+02 -0.15967E-02 -0.80051E-04 650 0.166E-01 0.354E-02
DAV: 17 -0.904380604961E+02 -0.71371E-03 -0.14363E-04 744 0.876E-02 0.228E-02
DAV: 18 -0.904382835925E+02 -0.22310E-03 -0.86061E-05 664 0.452E-02 0.909E-03
DAV: 19 -0.904384503426E+02 -0.16675E-03 -0.30024E-05 503 0.274E-02 0.465E-03
DAV: 20 -0.904384789490E+02 -0.28606E-04 -0.43572E-06 488 0.138E-02 0.588E-03
DAV: 21 -0.904385116865E+02 -0.32738E-04 -0.53111E-06 426 0.134E-02 0.442E-03
DAV: 22 -0.904385259153E+02 -0.14229E-04 -0.34909E-06 474 0.120E-02 0.211E-03
DAV: 23 -0.904385279478E+02 -0.20325E-05 -0.27243E-06 528 0.966E-03
1 F= -.90438528E+02 E0= -.90444025E+02 d E =0.164898E-01