iterations/neb0_image07_iter6_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 0.145198929615E+04 0.14520E+04 -0.44239E+04 330 0.697E+02
DAV: 2 0.229278241573E+03 -0.12227E+04 -0.11470E+04 426 0.163E+02
DAV: 3 -0.360808195431E+03 -0.59009E+03 -0.58671E+03 345 0.114E+02
DAV: 4 -0.432730109544E+03 -0.71922E+02 -0.71646E+02 318 0.512E+01
DAV: 5 -0.434357055008E+03 -0.16269E+01 -0.16242E+01 318 0.794E+00 0.426E+01
DAV: 6 -0.388603358526E+03 0.45754E+02 -0.14686E+02 309 0.286E+01 0.208E+01
DAV: 7 -0.385139002128E+03 0.34644E+01 -0.13215E+01 345 0.783E+00 0.104E+01
DAV: 8 -0.383712935225E+03 0.14261E+01 -0.25491E+00 345 0.395E+00 0.435E+00
DAV: 9 -0.383155674749E+03 0.55726E+00 -0.86490E-01 336 0.230E+00 0.128E+00
DAV: 10 -0.383100810823E+03 0.54864E-01 -0.52891E-01 336 0.122E+00 0.856E-01
DAV: 11 -0.383068732780E+03 0.32078E-01 -0.84000E-02 327 0.579E-01 0.804E-01
DAV: 12 -0.383053549275E+03 0.15184E-01 -0.10984E-01 399 0.494E-01 0.672E-01
DAV: 13 -0.383052862944E+03 0.68633E-03 -0.19414E-01 318 0.692E-01 0.101E+00
DAV: 14 -0.383024212103E+03 0.28651E-01 -0.20856E-02 327 0.432E-01 0.639E-01
DAV: 15 -0.383025885766E+03 -0.16737E-02 -0.39408E-02 363 0.498E-01 0.568E-01
DAV: 16 -0.383022814619E+03 0.30711E-02 -0.16493E-02 309 0.317E-01 0.305E-01
DAV: 17 -0.383027042036E+03 -0.42274E-02 -0.85638E-03 318 0.242E-01 0.183E-01
DAV: 18 -0.383034229136E+03 -0.71871E-02 -0.22791E-03 309 0.175E-01 0.135E-01
DAV: 19 -0.383046283756E+03 -0.12055E-01 -0.35049E-03 300 0.183E-01 0.133E-01
DAV: 20 -0.383053296197E+03 -0.70124E-02 -0.27911E-03 327 0.136E-01 0.794E-02
DAV: 21 -0.383058213480E+03 -0.49173E-02 -0.75234E-04 327 0.795E-02 0.492E-02
DAV: 22 -0.383063337243E+03 -0.51238E-02 -0.41905E-04 309 0.446E-02 0.500E-02
DAV: 23 -0.383068187316E+03 -0.48501E-02 -0.29753E-04 327 0.364E-02 0.481E-02
DAV: 24 -0.383070648610E+03 -0.24613E-02 -0.33079E-04 327 0.353E-02 0.371E-02
DAV: 25 -0.383071783196E+03 -0.11346E-02 -0.66308E-05 300 0.201E-02 0.275E-02
DAV: 26 -0.383072341574E+03 -0.55838E-03 -0.27642E-05 255 0.112E-02 0.125E-02
DAV: 27 -0.383073173995E+03 -0.83242E-03 -0.74820E-05 282 0.179E-02 0.168E-02
DAV: 28 -0.383073360287E+03 -0.18629E-03 -0.89541E-06 228 0.738E-03 0.819E-03
DAV: 29 -0.383073438920E+03 -0.78633E-04 -0.29730E-06 237 0.426E-03 0.600E-03
DAV: 30 -0.383073545402E+03 -0.10648E-03 -0.33750E-06 201 0.474E-03 0.269E-03
DAV: 31 -0.383073595932E+03 -0.50530E-04 -0.31332E-06 219 0.373E-03 0.405E-03
DAV: 32 -0.383073639525E+03 -0.43592E-04 -0.16019E-06 210 0.286E-03 0.151E-03
DAV: 33 -0.383073661768E+03 -0.22244E-04 -0.93603E-07 219 0.197E-03 0.777E-04
DAV: 34 -0.383073676929E+03 -0.15161E-04 -0.52398E-07 210 0.148E-03 0.484E-04
DAV: 35 -0.383073685556E+03 -0.86273E-05 -0.34755E-07 219 0.108E-03
1 F= -.38307369E+03 E0= -.38309049E+03 d E =0.504237E-01