./iterations/neb0_image04_iter200_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 0.365568539199E+03 0.36557E+03 -0.14325E+04 632 0.799E+02
DAV: 2 0.185137623459E+01 -0.36372E+03 -0.35103E+03 861 0.194E+02
DAV: 3 -0.959596978034E+02 -0.97811E+02 -0.97505E+02 661 0.116E+02
DAV: 4 -0.100284815263E+03 -0.43251E+01 -0.43164E+01 720 0.281E+01
DAV: 5 -0.100368261454E+03 -0.83446E-01 -0.83420E-01 720 0.351E+00 0.223E+01
DAV: 6 -0.916628608902E+02 0.87054E+01 -0.31159E+01 693 0.298E+01 0.116E+01
DAV: 7 -0.908014526685E+02 0.86141E+00 -0.17857E+00 704 0.636E+00 0.483E+00
DAV: 8 -0.903900619075E+02 0.41139E+00 -0.56351E-01 704 0.436E+00 0.169E+00
DAV: 9 -0.902974590743E+02 0.92603E-01 -0.12690E-01 720 0.201E+00 0.506E-01
DAV: 10 -0.902860602734E+02 0.11399E-01 -0.37283E-02 712 0.977E-01 0.360E-01
DAV: 11 -0.902883862746E+02 -0.23260E-02 -0.11602E-02 704 0.794E-01 0.287E-01
DAV: 12 -0.902893693677E+02 -0.98309E-03 -0.44081E-03 768 0.609E-01 0.118E-01
DAV: 13 -0.902935722925E+02 -0.42029E-02 -0.32538E-03 620 0.309E-01 0.976E-02
DAV: 14 -0.902972070801E+02 -0.36348E-02 -0.80836E-04 645 0.169E-01 0.468E-02
DAV: 15 -0.903003902389E+02 -0.31832E-02 -0.67723E-04 653 0.134E-01 0.319E-02
DAV: 16 -0.903024162842E+02 -0.20260E-02 -0.23672E-04 680 0.106E-01 0.187E-02
DAV: 17 -0.903036229489E+02 -0.12067E-02 -0.18527E-04 658 0.629E-02 0.211E-02
DAV: 18 -0.903040402974E+02 -0.41735E-03 -0.13052E-04 800 0.837E-02 0.137E-02
DAV: 19 -0.903041800489E+02 -0.13975E-03 -0.34742E-05 599 0.294E-02 0.149E-02
DAV: 20 -0.903042194370E+02 -0.39388E-04 -0.73998E-06 520 0.184E-02 0.923E-03
DAV: 21 -0.903043172668E+02 -0.97830E-04 -0.41485E-05 529 0.376E-02 0.694E-03
DAV: 22 -0.903043280662E+02 -0.10799E-04 -0.38894E-06 488 0.150E-02 0.516E-03
DAV: 23 -0.903043311581E+02 -0.30919E-05 -0.36267E-06 512 0.102E-02
1 F= -.90304331E+02 E0= -.90312819E+02 d E =0.254646E-01