iterations/neb0_image08_iter65_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 0.144036913370E+04 0.14404E+04 -0.44148E+04 330 0.697E+02
DAV: 2 0.234004619046E+03 -0.12064E+04 -0.11292E+04 408 0.163E+02
DAV: 3 -0.363666424808E+03 -0.59767E+03 -0.59378E+03 372 0.115E+02
DAV: 4 -0.428653564993E+03 -0.64987E+02 -0.64692E+02 309 0.468E+01
DAV: 5 -0.430103900759E+03 -0.14503E+01 -0.14478E+01 345 0.725E+00 0.421E+01
DAV: 6 -0.384977814474E+03 0.45126E+02 -0.15027E+02 309 0.288E+01 0.205E+01
DAV: 7 -0.381660823339E+03 0.33170E+01 -0.11707E+01 336 0.768E+00 0.103E+01
DAV: 8 -0.380220391923E+03 0.14404E+01 -0.19070E+00 336 0.383E+00 0.414E+00
DAV: 9 -0.379667719412E+03 0.55267E+00 -0.56996E-01 327 0.183E+00 0.910E-01
DAV: 10 -0.379607428470E+03 0.60291E-01 -0.93051E-02 336 0.800E-01 0.623E-01
DAV: 11 -0.379577997077E+03 0.29431E-01 -0.18911E-02 327 0.416E-01 0.501E-01
DAV: 12 -0.379572229988E+03 0.57671E-02 -0.13872E-02 363 0.323E-01 0.325E-01
DAV: 13 -0.379562626604E+03 0.96034E-02 -0.10287E-02 309 0.327E-01 0.214E-01
DAV: 14 -0.379566908720E+03 -0.42821E-02 -0.13418E-02 327 0.342E-01 0.315E-01
DAV: 15 -0.379574890914E+03 -0.79822E-02 -0.79248E-03 354 0.326E-01 0.125E-01
DAV: 16 -0.379584948730E+03 -0.10058E-01 -0.57456E-03 336 0.250E-01 0.109E-01
DAV: 17 -0.379589711438E+03 -0.47627E-02 -0.17228E-03 318 0.111E-01 0.874E-02
DAV: 18 -0.379594445126E+03 -0.47337E-02 -0.37012E-04 309 0.422E-02 0.531E-02
DAV: 19 -0.379600857684E+03 -0.64126E-02 -0.29384E-04 291 0.462E-02 0.273E-02
DAV: 20 -0.379607801644E+03 -0.69440E-02 -0.47576E-04 318 0.470E-02 0.169E-02
DAV: 21 -0.379611500304E+03 -0.36987E-02 -0.23142E-04 309 0.317E-02 0.104E-02
DAV: 22 -0.379612899626E+03 -0.13993E-02 -0.51618E-05 300 0.159E-02 0.836E-03
DAV: 23 -0.379613890873E+03 -0.99125E-03 -0.45285E-05 273 0.132E-02 0.596E-03
DAV: 24 -0.379614253593E+03 -0.36272E-03 -0.12010E-05 237 0.783E-03 0.333E-03
DAV: 25 -0.379614444897E+03 -0.19130E-03 -0.97026E-06 210 0.718E-03 0.364E-03
DAV: 26 -0.379614544193E+03 -0.99295E-04 -0.29813E-06 219 0.431E-03 0.286E-03
DAV: 27 -0.379614610250E+03 -0.66057E-04 -0.41481E-06 228 0.577E-03 0.145E-03
DAV: 28 -0.379614639338E+03 -0.29088E-04 -0.15351E-06 219 0.323E-03 0.950E-04
DAV: 29 -0.379614654760E+03 -0.15422E-04 -0.88399E-07 228 0.197E-03 0.980E-04
DAV: 30 -0.379614665614E+03 -0.10854E-04 -0.42958E-07 219 0.160E-03 0.495E-04
DAV: 31 -0.379614671599E+03 -0.59848E-05 -0.37263E-07 219 0.133E-03
1 F= -.37961467E+03 E0= -.37962322E+03 d E =0.256523E-01