iterations/neb0_image04_iter74_OSZICAR.out output for 3: !!! 3.3A-->1.3A 709 (amd-9) Si-H2N...HCH2-Si two dimer (TSS)
Status:
terminated
N E dE d eps ncg rms rms(c)
DAV: 1 0.144854165905E+04 0.14485E+04 -0.44197E+04 330 0.697E+02
DAV: 2 0.224638694123E+03 -0.12239E+04 -0.11488E+04 435 0.163E+02
DAV: 3 -0.362558474040E+03 -0.58720E+03 -0.58405E+03 345 0.114E+02
DAV: 4 -0.433280197913E+03 -0.70722E+02 -0.70472E+02 309 0.508E+01
DAV: 5 -0.434872912824E+03 -0.15927E+01 -0.15901E+01 327 0.784E+00 0.426E+01
DAV: 6 -0.389013606134E+03 0.45859E+02 -0.14765E+02 309 0.286E+01 0.208E+01
DAV: 7 -0.385564448037E+03 0.34492E+01 -0.13638E+01 345 0.782E+00 0.104E+01
DAV: 8 -0.384105468899E+03 0.14590E+01 -0.23774E+00 336 0.391E+00 0.431E+00
DAV: 9 -0.383548285117E+03 0.55718E+00 -0.11674E+00 327 0.231E+00 0.123E+00
DAV: 10 -0.383470566147E+03 0.77719E-01 -0.18892E-01 327 0.110E+00 0.823E-01
DAV: 11 -0.383447784883E+03 0.22781E-01 -0.84604E-02 327 0.594E-01 0.646E-01
DAV: 12 -0.383426036390E+03 0.21748E-01 -0.22970E-02 354 0.470E-01 0.516E-01
DAV: 13 -0.383415176339E+03 0.10860E-01 -0.17206E-02 345 0.402E-01 0.466E-01
DAV: 14 -0.383410589467E+03 0.45869E-02 -0.40245E-02 318 0.408E-01 0.468E-01
DAV: 15 -0.383409620585E+03 0.96888E-03 -0.12393E-02 327 0.331E-01 0.242E-01
DAV: 16 -0.383419345266E+03 -0.97247E-02 -0.10166E-02 282 0.258E-01 0.136E-01
DAV: 17 -0.383430794128E+03 -0.11449E-01 -0.34205E-03 309 0.185E-01 0.890E-02
DAV: 18 -0.383439373280E+03 -0.85792E-02 -0.14771E-03 336 0.108E-01 0.638E-02
DAV: 19 -0.383446043262E+03 -0.66700E-02 -0.28654E-04 318 0.439E-02 0.421E-02
DAV: 20 -0.383454194419E+03 -0.81512E-02 -0.50961E-04 309 0.437E-02 0.214E-02
DAV: 21 -0.383457294362E+03 -0.30999E-02 -0.12921E-04 327 0.250E-02 0.131E-02
DAV: 22 -0.383460411922E+03 -0.31176E-02 -0.17056E-04 282 0.244E-02 0.121E-02
DAV: 23 -0.383461480176E+03 -0.10683E-02 -0.42829E-05 300 0.136E-02 0.894E-03
DAV: 24 -0.383462293451E+03 -0.81327E-03 -0.41752E-05 273 0.135E-02 0.599E-03
DAV: 25 -0.383462481318E+03 -0.18787E-03 -0.42910E-06 237 0.587E-03 0.333E-03
DAV: 26 -0.383462679480E+03 -0.19816E-03 -0.88604E-06 201 0.720E-03 0.317E-03
DAV: 27 -0.383462739266E+03 -0.59786E-04 -0.20934E-06 228 0.395E-03 0.243E-03
DAV: 28 -0.383462794737E+03 -0.55471E-04 -0.37625E-06 210 0.579E-03 0.176E-03
DAV: 29 -0.383462823822E+03 -0.29085E-04 -0.13626E-06 219 0.314E-03 0.101E-03
DAV: 30 -0.383462835912E+03 -0.12090E-04 -0.74844E-07 219 0.192E-03 0.539E-04
DAV: 31 -0.383462846319E+03 -0.10406E-04 -0.33740E-07 210 0.109E-03 0.442E-04
DAV: 32 -0.383462853358E+03 -0.70392E-05 -0.21633E-07 219 0.895E-04
1 F= -.38346285E+03 E0= -.38347611E+03 d E =0.397747E-01