./iterations/neb0_image07_iter204_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 0.370951175601E+03 0.37095E+03 -0.14321E+04 632 0.799E+02
DAV: 2 0.348546620919E+01 -0.36747E+03 -0.35520E+03 869 0.194E+02
DAV: 3 -0.965286930509E+02 -0.10001E+03 -0.99711E+02 685 0.116E+02
DAV: 4 -0.101078551986E+03 -0.45499E+01 -0.45371E+01 720 0.280E+01
DAV: 5 -0.101169769110E+03 -0.91217E-01 -0.91161E-01 728 0.355E+00 0.226E+01
DAV: 6 -0.925742759250E+02 0.85955E+01 -0.30682E+01 717 0.299E+01 0.118E+01
DAV: 7 -0.917284553380E+02 0.84582E+00 -0.17266E+00 712 0.617E+00 0.479E+00
DAV: 8 -0.913564755502E+02 0.37198E+00 -0.53527E-01 728 0.396E+00 0.162E+00
DAV: 9 -0.912753997434E+02 0.81076E-01 -0.12900E-01 728 0.156E+00 0.419E-01
DAV: 10 -0.912667369507E+02 0.86628E-02 -0.40483E-02 736 0.104E+00 0.289E-01
DAV: 11 -0.912711533106E+02 -0.44164E-02 -0.11864E-02 616 0.571E-01 0.146E-01
DAV: 12 -0.912738763599E+02 -0.27230E-02 -0.23522E-03 640 0.251E-01 0.910E-02
DAV: 13 -0.912779147050E+02 -0.40383E-02 -0.17955E-03 631 0.215E-01 0.537E-02
DAV: 14 -0.912802391455E+02 -0.23244E-02 -0.51996E-04 824 0.184E-01 0.352E-02
DAV: 15 -0.912825158724E+02 -0.22767E-02 -0.44040E-04 639 0.103E-01 0.323E-02
DAV: 16 -0.912834903155E+02 -0.97444E-03 -0.12162E-04 728 0.694E-02 0.139E-02
DAV: 17 -0.912843350846E+02 -0.84477E-03 -0.16222E-04 733 0.691E-02 0.175E-02
DAV: 18 -0.912845386669E+02 -0.20358E-03 -0.39334E-05 624 0.485E-02 0.769E-03
DAV: 19 -0.912845816979E+02 -0.43031E-04 -0.16713E-05 541 0.217E-02 0.563E-03
DAV: 20 -0.912846688796E+02 -0.87182E-04 -0.83420E-06 417 0.152E-02 0.219E-03
DAV: 21 -0.912846986260E+02 -0.29746E-04 -0.47866E-06 488 0.117E-02 0.220E-03
DAV: 22 -0.912847095936E+02 -0.10968E-04 -0.11956E-06 434 0.721E-03 0.119E-03
DAV: 23 -0.912847143203E+02 -0.47268E-05 -0.24444E-06 450 0.951E-03
1 F= -.91284714E+02 E0= -.91290069E+02 d E =0.160655E-01