./iterations/neb0_image05_iter26_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 0.364974408783E+03 0.36497E+03 -0.14275E+04 632 0.799E+02
DAV: 2 0.515506226099E+01 -0.35982E+03 -0.34778E+03 861 0.193E+02
DAV: 3 -0.926675593596E+02 -0.97823E+02 -0.97360E+02 648 0.115E+02
DAV: 4 -0.975367136047E+02 -0.48692E+01 -0.48531E+01 712 0.296E+01
DAV: 5 -0.976414055628E+02 -0.10469E+00 -0.10464E+00 712 0.386E+00 0.214E+01
DAV: 6 -0.893704196450E+02 0.82710E+01 -0.30387E+01 696 0.298E+01 0.110E+01
DAV: 7 -0.886295537351E+02 0.74087E+00 -0.16054E+00 696 0.663E+00 0.470E+00
DAV: 8 -0.882708153701E+02 0.35874E+00 -0.61673E-01 712 0.437E+00 0.165E+00
DAV: 9 -0.881863433144E+02 0.84472E-01 -0.13127E-01 728 0.172E+00 0.455E-01
DAV: 10 -0.881772401280E+02 0.91032E-02 -0.23196E-02 741 0.785E-01 0.288E-01
DAV: 11 -0.881799193368E+02 -0.26792E-02 -0.12749E-02 645 0.742E-01 0.157E-01
DAV: 12 -0.881815115349E+02 -0.15922E-02 -0.23961E-03 671 0.342E-01 0.113E-01
DAV: 13 -0.881860339745E+02 -0.45224E-02 -0.49061E-03 609 0.427E-01 0.110E-01
DAV: 14 -0.881884351292E+02 -0.24012E-02 -0.12788E-03 933 0.281E-01 0.483E-02
DAV: 15 -0.881907216940E+02 -0.22866E-02 -0.11158E-03 645 0.204E-01 0.554E-02
DAV: 16 -0.881922388793E+02 -0.15172E-02 -0.31279E-04 805 0.134E-01 0.284E-02
DAV: 17 -0.881930280102E+02 -0.78913E-03 -0.25734E-04 693 0.953E-02 0.157E-02
DAV: 18 -0.881938032651E+02 -0.77525E-03 -0.84196E-05 647 0.468E-02 0.120E-02
DAV: 19 -0.881940247331E+02 -0.22147E-03 -0.24222E-05 557 0.266E-02 0.572E-03
DAV: 20 -0.881941569632E+02 -0.13223E-03 -0.17139E-05 450 0.198E-02 0.230E-03
DAV: 21 -0.881941935972E+02 -0.36634E-04 -0.40924E-06 504 0.809E-03 0.210E-03
DAV: 22 -0.881942149680E+02 -0.21371E-04 -0.37169E-06 415 0.865E-03 0.115E-03
DAV: 23 -0.881942176418E+02 -0.26737E-05 -0.84637E-07 501 0.401E-03
1 F= -.88194218E+02 E0= -.88198119E+02 d E =0.117035E-01