./iterations/neb0_image09_iter153_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 0.374281080525E+03 0.37428E+03 -0.14281E+04 624 0.799E+02
DAV: 2 0.333014101759E+01 -0.37095E+03 -0.35811E+03 869 0.196E+02
DAV: 3 -0.967132581052E+02 -0.10004E+03 -0.99711E+02 661 0.117E+02
DAV: 4 -0.101259663224E+03 -0.45464E+01 -0.45358E+01 720 0.287E+01
DAV: 5 -0.101348580618E+03 -0.88917E-01 -0.88877E-01 728 0.365E+00 0.227E+01
DAV: 6 -0.926761444043E+02 0.86724E+01 -0.30962E+01 728 0.301E+01 0.119E+01
DAV: 7 -0.918072599989E+02 0.86888E+00 -0.17323E+00 720 0.615E+00 0.480E+00
DAV: 8 -0.914306568902E+02 0.37660E+00 -0.54459E-01 712 0.395E+00 0.163E+00
DAV: 9 -0.913483918971E+02 0.82265E-01 -0.13153E-01 712 0.156E+00 0.424E-01
DAV: 10 -0.913398905582E+02 0.85013E-02 -0.44084E-02 776 0.110E+00 0.299E-01
DAV: 11 -0.913440860949E+02 -0.41955E-02 -0.11223E-02 616 0.555E-01 0.128E-01
DAV: 12 -0.913473048645E+02 -0.32188E-02 -0.28770E-03 626 0.252E-01 0.112E-01
DAV: 13 -0.913508511582E+02 -0.35463E-02 -0.11146E-03 672 0.187E-01 0.466E-02
DAV: 14 -0.913540142080E+02 -0.31630E-02 -0.77869E-04 664 0.144E-01 0.405E-02
DAV: 15 -0.913556596770E+02 -0.16455E-02 -0.17308E-04 728 0.887E-02 0.345E-02
DAV: 16 -0.913570919048E+02 -0.14322E-02 -0.32278E-04 655 0.858E-02 0.173E-02
DAV: 17 -0.913575398978E+02 -0.44799E-03 -0.66432E-05 672 0.531E-02 0.143E-02
DAV: 18 -0.913578007303E+02 -0.26083E-03 -0.46416E-05 637 0.317E-02 0.991E-03
DAV: 19 -0.913578434926E+02 -0.42762E-04 -0.64840E-06 512 0.162E-02 0.499E-03
DAV: 20 -0.913578806445E+02 -0.37152E-04 -0.95693E-06 412 0.188E-02 0.195E-03
DAV: 21 -0.913578983191E+02 -0.17675E-04 -0.28546E-06 464 0.792E-03 0.260E-03
DAV: 22 -0.913579028368E+02 -0.45177E-05 -0.62350E-07 466 0.483E-03
1 F= -.91357903E+02 E0= -.91362820E+02 d E =0.147520E-01