iterations/neb0_image02_iter17_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 0.144813216375E+04 0.14481E+04 -0.44194E+04 330 0.697E+02
DAV: 2 0.224485300537E+03 -0.12236E+04 -0.11470E+04 435 0.163E+02
DAV: 3 -0.362862494157E+03 -0.58735E+03 -0.58421E+03 345 0.114E+02
DAV: 4 -0.433469260570E+03 -0.70607E+02 -0.70370E+02 309 0.508E+01
DAV: 5 -0.435053155409E+03 -0.15839E+01 -0.15813E+01 318 0.781E+00 0.426E+01
DAV: 6 -0.389088342849E+03 0.45965E+02 -0.14803E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385619225904E+03 0.34691E+01 -0.13418E+01 345 0.778E+00 0.104E+01
DAV: 8 -0.384141481560E+03 0.14777E+01 -0.20379E+00 327 0.381E+00 0.430E+00
DAV: 9 -0.383597724006E+03 0.54376E+00 -0.14497E+00 336 0.236E+00 0.130E+00
DAV: 10 -0.383543324012E+03 0.54400E-01 -0.38308E-01 318 0.113E+00 0.996E-01
DAV: 11 -0.383506226065E+03 0.37098E-01 -0.12232E-01 336 0.643E-01 0.832E-01
DAV: 12 -0.383493736953E+03 0.12489E-01 -0.15417E-01 336 0.716E-01 0.972E-01
DAV: 13 -0.383475257890E+03 0.18479E-01 -0.17313E-01 363 0.531E-01 0.705E-01
DAV: 14 -0.383462491201E+03 0.12767E-01 -0.66817E-02 345 0.382E-01 0.393E-01
DAV: 15 -0.383459965706E+03 0.25255E-02 -0.36421E-02 309 0.394E-01 0.427E-01
DAV: 16 -0.383461696523E+03 -0.17308E-02 -0.22923E-02 345 0.285E-01 0.239E-01
DAV: 17 -0.383467178591E+03 -0.54821E-02 -0.46987E-03 300 0.198E-01 0.151E-01
DAV: 18 -0.383472428187E+03 -0.52496E-02 -0.17460E-03 309 0.112E-01 0.110E-01
DAV: 19 -0.383482474640E+03 -0.10046E-01 -0.19193E-03 291 0.128E-01 0.111E-01
DAV: 20 -0.383489654609E+03 -0.71800E-02 -0.11632E-03 318 0.982E-02 0.612E-02
DAV: 21 -0.383496479546E+03 -0.68249E-02 -0.86031E-04 336 0.685E-02 0.454E-02
DAV: 22 -0.383501977616E+03 -0.54981E-02 -0.47318E-04 309 0.474E-02 0.495E-02
DAV: 23 -0.383505280999E+03 -0.33034E-02 -0.24705E-04 318 0.375E-02 0.307E-02
DAV: 24 -0.383507327461E+03 -0.20465E-02 -0.13418E-04 300 0.251E-02 0.250E-02
DAV: 25 -0.383508932714E+03 -0.16053E-02 -0.83232E-05 300 0.217E-02 0.208E-02
DAV: 26 -0.383509825940E+03 -0.89323E-03 -0.43883E-05 309 0.158E-02 0.102E-02
DAV: 27 -0.383510302191E+03 -0.47625E-03 -0.16974E-05 237 0.823E-03 0.957E-03
DAV: 28 -0.383510596818E+03 -0.29463E-03 -0.11667E-05 228 0.671E-03 0.392E-03
DAV: 29 -0.383510757478E+03 -0.16066E-03 -0.63880E-06 228 0.539E-03 0.432E-03
DAV: 30 -0.383510813787E+03 -0.56309E-04 -0.20620E-06 228 0.317E-03 0.160E-03
DAV: 31 -0.383510867891E+03 -0.54104E-04 -0.24306E-06 183 0.331E-03 0.164E-03
DAV: 32 -0.383510879102E+03 -0.11212E-04 -0.77278E-07 228 0.178E-03 0.168E-03
DAV: 33 -0.383510886270E+03 -0.71679E-05 -0.38778E-07 192 0.133E-03
1 F= -.38351089E+03 E0= -.38352754E+03 d E =0.499730E-01