./iterations/neb0_image06_iter25_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 0.366775642458E+03 0.36678E+03 -0.14267E+04 632 0.799E+02
DAV: 2 0.375338665630E+01 -0.36302E+03 -0.34949E+03 869 0.194E+02
DAV: 3 -0.945738707276E+02 -0.98327E+02 -0.97912E+02 672 0.115E+02
DAV: 4 -0.990367116513E+02 -0.44628E+01 -0.44500E+01 704 0.279E+01
DAV: 5 -0.991279907279E+02 -0.91279E-01 -0.91249E-01 720 0.355E+00 0.220E+01
DAV: 6 -0.904378962780E+02 0.86901E+01 -0.31162E+01 709 0.303E+01 0.114E+01
DAV: 7 -0.896007517916E+02 0.83714E+00 -0.16937E+00 712 0.677E+00 0.480E+00
DAV: 8 -0.892158561593E+02 0.38490E+00 -0.62971E-01 696 0.441E+00 0.168E+00
DAV: 9 -0.891296326251E+02 0.86224E-01 -0.13522E-01 720 0.175E+00 0.490E-01
DAV: 10 -0.891186351578E+02 0.10997E-01 -0.23631E-02 784 0.818E-01 0.280E-01
DAV: 11 -0.891201583982E+02 -0.15232E-02 -0.99768E-03 605 0.545E-01 0.151E-01
DAV: 12 -0.891231119491E+02 -0.29536E-02 -0.26011E-03 804 0.414E-01 0.103E-01
DAV: 13 -0.891266112545E+02 -0.34993E-02 -0.26693E-03 650 0.270E-01 0.103E-01
DAV: 14 -0.891296057750E+02 -0.29945E-02 -0.11556E-03 645 0.174E-01 0.375E-02
DAV: 15 -0.891324245051E+02 -0.28187E-02 -0.54184E-04 712 0.116E-01 0.380E-02
DAV: 16 -0.891342169186E+02 -0.17924E-02 -0.18237E-04 682 0.705E-02 0.141E-02
DAV: 17 -0.891351508812E+02 -0.93396E-03 -0.10763E-04 668 0.492E-02 0.115E-02
DAV: 18 -0.891355291460E+02 -0.37826E-03 -0.43848E-05 599 0.368E-02 0.797E-03
DAV: 19 -0.891356800678E+02 -0.15092E-03 -0.15827E-05 477 0.215E-02 0.592E-03
DAV: 20 -0.891357219411E+02 -0.41873E-04 -0.74807E-06 477 0.169E-02 0.198E-03
DAV: 21 -0.891357483649E+02 -0.26424E-04 -0.50467E-06 423 0.121E-02 0.241E-03
DAV: 22 -0.891357604623E+02 -0.12097E-04 -0.14774E-06 445 0.584E-03 0.170E-03
DAV: 23 -0.891357658750E+02 -0.54127E-05 -0.15392E-06 408 0.720E-03
1 F= -.89135766E+02 E0= -.89145967E+02 d E =0.306025E-01