iterations/neb0_image07_iter61_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 0.144247017833E+04 0.14425E+04 -0.44185E+04 330 0.697E+02
DAV: 2 0.229796451619E+03 -0.12127E+04 -0.11367E+04 417 0.163E+02
DAV: 3 -0.359053351659E+03 -0.58885E+03 -0.58532E+03 354 0.114E+02
DAV: 4 -0.429865877703E+03 -0.70813E+02 -0.70520E+02 309 0.508E+01
DAV: 5 -0.431492720804E+03 -0.16268E+01 -0.16240E+01 345 0.787E+00 0.423E+01
DAV: 6 -0.386265167832E+03 0.45228E+02 -0.14768E+02 309 0.286E+01 0.207E+01
DAV: 7 -0.382959107699E+03 0.33061E+01 -0.12641E+01 336 0.773E+00 0.103E+01
DAV: 8 -0.381528228839E+03 0.14309E+01 -0.19099E+00 336 0.386E+00 0.423E+00
DAV: 9 -0.380973650092E+03 0.55458E+00 -0.59824E-01 336 0.191E+00 0.921E-01
DAV: 10 -0.380912563479E+03 0.61087E-01 -0.11204E-01 336 0.909E-01 0.685E-01
DAV: 11 -0.380887684027E+03 0.24879E-01 -0.12048E-01 354 0.556E-01 0.896E-01
DAV: 12 -0.380874845259E+03 0.12839E-01 -0.11594E-01 381 0.366E-01 0.457E-01
DAV: 13 -0.380863123954E+03 0.11721E-01 -0.37460E-02 309 0.461E-01 0.541E-01
DAV: 14 -0.380859761623E+03 0.33623E-02 -0.12013E-02 327 0.259E-01 0.384E-01
DAV: 15 -0.380861745742E+03 -0.19841E-02 -0.10145E-02 300 0.267E-01 0.150E-01
DAV: 16 -0.380869826052E+03 -0.80803E-02 -0.44132E-03 336 0.207E-01 0.109E-01
DAV: 17 -0.380881826410E+03 -0.12000E-01 -0.18721E-03 309 0.155E-01 0.713E-02
DAV: 18 -0.380891980912E+03 -0.10155E-01 -0.18537E-03 318 0.138E-01 0.684E-02
DAV: 19 -0.380898550107E+03 -0.65692E-02 -0.83839E-04 327 0.760E-02 0.443E-02
DAV: 20 -0.380903597405E+03 -0.50473E-02 -0.20099E-04 318 0.331E-02 0.304E-02
DAV: 21 -0.380907702601E+03 -0.41052E-02 -0.21659E-04 309 0.318E-02 0.170E-02
DAV: 22 -0.380909995754E+03 -0.22932E-02 -0.10914E-04 309 0.202E-02 0.201E-02
DAV: 23 -0.380911340393E+03 -0.13446E-02 -0.52188E-05 291 0.155E-02 0.103E-02
DAV: 24 -0.380911909918E+03 -0.56953E-03 -0.14974E-05 255 0.835E-03 0.481E-03
DAV: 25 -0.380912441569E+03 -0.53165E-03 -0.21743E-05 246 0.898E-03 0.426E-03
DAV: 26 -0.380912633064E+03 -0.19150E-03 -0.55717E-06 228 0.557E-03 0.247E-03
DAV: 27 -0.380912724455E+03 -0.91391E-04 -0.34676E-06 228 0.453E-03 0.116E-03
DAV: 28 -0.380912767152E+03 -0.42697E-04 -0.16914E-06 228 0.294E-03 0.126E-03
DAV: 29 -0.380912797511E+03 -0.30358E-04 -0.10927E-06 210 0.284E-03 0.586E-04
DAV: 30 -0.380912814476E+03 -0.16966E-04 -0.84461E-07 228 0.188E-03 0.977E-04
DAV: 31 -0.380912821861E+03 -0.73844E-05 -0.37267E-07 210 0.173E-03
1 F= -.38091282E+03 E0= -.38092960E+03 d E =0.503312E-01