iterations/neb0_image07_iter1_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 0.145147446578E+04 0.14515E+04 -0.44239E+04 330 0.697E+02
DAV: 2 0.229816227612E+03 -0.12217E+04 -0.11468E+04 426 0.163E+02
DAV: 3 -0.360331602108E+03 -0.59015E+03 -0.58677E+03 345 0.114E+02
DAV: 4 -0.432481804717E+03 -0.72150E+02 -0.71873E+02 309 0.513E+01
DAV: 5 -0.434120471988E+03 -0.16387E+01 -0.16357E+01 318 0.795E+00 0.426E+01
DAV: 6 -0.388432410617E+03 0.45688E+02 -0.14678E+02 309 0.286E+01 0.208E+01
DAV: 7 -0.384978945183E+03 0.34535E+01 -0.13289E+01 345 0.783E+00 0.104E+01
DAV: 8 -0.383533452321E+03 0.14455E+01 -0.20003E+00 345 0.387E+00 0.429E+00
DAV: 9 -0.383008512429E+03 0.52494E+00 -0.14977E+00 336 0.240E+00 0.139E+00
DAV: 10 -0.382938778826E+03 0.69734E-01 -0.33354E-01 336 0.118E+00 0.119E+00
DAV: 11 -0.382913197378E+03 0.25581E-01 -0.35278E-01 354 0.738E-01 0.785E-01
DAV: 12 -0.382894918812E+03 0.18279E-01 -0.13388E-01 336 0.641E-01 0.674E-01
DAV: 13 -0.382871486277E+03 0.23433E-01 -0.24238E-02 345 0.520E-01 0.468E-01
DAV: 14 -0.382869117147E+03 0.23691E-02 -0.62679E-02 345 0.489E-01 0.600E-01
DAV: 15 -0.382860515410E+03 0.86017E-02 -0.24015E-02 327 0.435E-01 0.223E-01
DAV: 16 -0.382863762554E+03 -0.32471E-02 -0.53642E-03 318 0.239E-01 0.167E-01
DAV: 17 -0.382871710880E+03 -0.79483E-02 -0.29384E-03 300 0.193E-01 0.131E-01
DAV: 18 -0.382886994564E+03 -0.15284E-01 -0.50352E-03 309 0.253E-01 0.188E-01
DAV: 19 -0.382891605755E+03 -0.46112E-02 -0.20863E-03 327 0.130E-01 0.780E-02
DAV: 20 -0.382896004462E+03 -0.43987E-02 -0.47218E-04 309 0.531E-02 0.508E-02
DAV: 21 -0.382903901293E+03 -0.78968E-02 -0.58575E-04 309 0.616E-02 0.848E-02
DAV: 22 -0.382906981825E+03 -0.30805E-02 -0.14452E-04 327 0.351E-02 0.389E-02
DAV: 23 -0.382910895386E+03 -0.39136E-02 -0.39842E-04 309 0.427E-02 0.216E-02
DAV: 24 -0.382911648259E+03 -0.75287E-03 -0.37786E-05 327 0.169E-02 0.183E-02
DAV: 25 -0.382912240507E+03 -0.59225E-03 -0.23584E-05 255 0.117E-02 0.110E-02
DAV: 26 -0.382912899534E+03 -0.65903E-03 -0.27939E-05 273 0.118E-02 0.123E-02
DAV: 27 -0.382913208722E+03 -0.30919E-03 -0.96386E-06 219 0.903E-03 0.368E-03
DAV: 28 -0.382913318380E+03 -0.10966E-03 -0.41253E-06 228 0.415E-03 0.267E-03
DAV: 29 -0.382913433773E+03 -0.11539E-03 -0.36162E-06 201 0.492E-03 0.249E-03
DAV: 30 -0.382913479965E+03 -0.46192E-04 -0.23539E-06 210 0.356E-03 0.209E-03
DAV: 31 -0.382913495525E+03 -0.15560E-04 -0.79798E-07 237 0.230E-03 0.145E-03
DAV: 32 -0.382913515362E+03 -0.19836E-04 -0.12132E-06 192 0.293E-03 0.184E-03
DAV: 33 -0.382913520073E+03 -0.47109E-05 -0.32006E-07 219 0.183E-03
1 F= -.38291352E+03 E0= -.38292672E+03 d E =0.396116E-01