iterations/neb0_image07_iter141_OSZICAR.out output for 44: 750-->752: Si-OH + Si-H , to Si-O-SI + H2 (TSS)
Status: finishedN E dE d eps ncg rms rms(c) DAV: 1 0.372784677396E+03 0.37278E+03 -0.14316E+04 632 0.799E+02 DAV: 2 0.387813903120E+01 -0.36891E+03 -0.35651E+03 869 0.194E+02 DAV: 3 -0.966116213237E+02 -0.10049E+03 -0.10015E+03 696 0.116E+02 DAV: 4 -0.101054271609E+03 -0.44427E+01 -0.44299E+01 704 0.276E+01 DAV: 5 -0.101141923457E+03 -0.87652E-01 -0.87615E-01 736 0.348E+00 0.227E+01 DAV: 6 -0.925431174432E+02 0.85988E+01 -0.30705E+01 704 0.301E+01 0.119E+01 DAV: 7 -0.916865049245E+02 0.85661E+00 -0.16711E+00 720 0.614E+00 0.480E+00 DAV: 8 -0.913125617346E+02 0.37394E+00 -0.54046E-01 712 0.397E+00 0.163E+00 DAV: 9 -0.912308059668E+02 0.81756E-01 -0.12790E-01 728 0.154E+00 0.423E-01 DAV: 10 -0.912218398970E+02 0.89661E-02 -0.43140E-02 725 0.107E+00 0.297E-01 DAV: 11 -0.912266410630E+02 -0.48012E-02 -0.13427E-02 605 0.601E-01 0.158E-01 DAV: 12 -0.912292917874E+02 -0.26507E-02 -0.25141E-03 628 0.232E-01 0.114E-01 DAV: 13 -0.912330812261E+02 -0.37894E-02 -0.19867E-03 637 0.244E-01 0.454E-02 DAV: 14 -0.912357439379E+02 -0.26627E-02 -0.39728E-04 680 0.116E-01 0.282E-02 DAV: 15 -0.912381637720E+02 -0.24198E-02 -0.25815E-04 642 0.703E-02 0.297E-02 DAV: 16 -0.912391242486E+02 -0.96048E-03 -0.17665E-04 688 0.651E-02 0.116E-02 DAV: 17 -0.912396811545E+02 -0.55691E-03 -0.47396E-05 589 0.272E-02 0.106E-02 DAV: 18 -0.912398653407E+02 -0.18419E-03 -0.16907E-05 528 0.178E-02 0.497E-03 DAV: 19 -0.912399403077E+02 -0.74967E-04 -0.13392E-05 458 0.156E-02 0.278E-03 DAV: 20 -0.912399572509E+02 -0.16943E-04 -0.22161E-06 456 0.760E-03 0.165E-03 DAV: 21 -0.912399640559E+02 -0.68050E-05 -0.15696E-06 431 0.567E-03 1 F= -.91239964E+02 E0= -.91244576E+02 d E =0.138372E-01