./iterations/neb0_image06_iter101_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 0.375424115707E+03 0.37542E+03 -0.14310E+04 632 0.799E+02
DAV: 2 0.368140329849E+01 -0.37174E+03 -0.35969E+03 877 0.195E+02
DAV: 3 -0.954750868854E+02 -0.99156E+02 -0.98830E+02 640 0.117E+02
DAV: 4 -0.100219271891E+03 -0.47442E+01 -0.47327E+01 712 0.297E+01
DAV: 5 -0.100316329644E+03 -0.97058E-01 -0.97014E-01 736 0.380E+00 0.226E+01
DAV: 6 -0.917111269648E+02 0.86052E+01 -0.30785E+01 698 0.305E+01 0.118E+01
DAV: 7 -0.908823053866E+02 0.82882E+00 -0.17143E+00 720 0.627E+00 0.480E+00
DAV: 8 -0.905024611343E+02 0.37984E+00 -0.52662E-01 720 0.404E+00 0.165E+00
DAV: 9 -0.904122631958E+02 0.90198E-01 -0.13116E-01 720 0.165E+00 0.422E-01
DAV: 10 -0.904026794664E+02 0.95837E-02 -0.41933E-02 744 0.105E+00 0.301E-01
DAV: 11 -0.904071206620E+02 -0.44412E-02 -0.12618E-02 613 0.653E-01 0.163E-01
DAV: 12 -0.904087646751E+02 -0.16440E-02 -0.23344E-03 672 0.275E-01 0.111E-01
DAV: 13 -0.904132581269E+02 -0.44935E-02 -0.29785E-03 641 0.364E-01 0.711E-02
DAV: 14 -0.904151376166E+02 -0.18795E-02 -0.48769E-04 712 0.135E-01 0.512E-02
DAV: 15 -0.904179963409E+02 -0.28587E-02 -0.77122E-04 637 0.156E-01 0.342E-02
DAV: 16 -0.904195383982E+02 -0.15421E-02 -0.19673E-04 693 0.812E-02 0.272E-02
DAV: 17 -0.904201108695E+02 -0.57247E-03 -0.11822E-04 784 0.742E-02 0.148E-02
DAV: 18 -0.904207757556E+02 -0.66489E-03 -0.13917E-04 652 0.777E-02 0.142E-02
DAV: 19 -0.904209889030E+02 -0.21315E-03 -0.26020E-05 490 0.354E-02 0.110E-02
DAV: 20 -0.904210694633E+02 -0.80560E-04 -0.28436E-05 544 0.304E-02 0.532E-03
DAV: 21 -0.904211425904E+02 -0.73127E-04 -0.78222E-06 436 0.141E-02 0.391E-03
DAV: 22 -0.904211639533E+02 -0.21363E-04 -0.37457E-06 469 0.931E-03 0.358E-03
DAV: 23 -0.904211726336E+02 -0.86803E-05 -0.33768E-06 394 0.132E-02
1 F= -.90421173E+02 E0= -.90427443E+02 d E =0.188106E-01