iterations/neb0_image09_iter31_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 0.144872652871E+04 0.14487E+04 -0.44241E+04 330 0.697E+02
DAV: 2 0.238073374706E+03 -0.12107E+04 -0.11365E+04 408 0.163E+02
DAV: 3 -0.361136151030E+03 -0.59921E+03 -0.59490E+03 354 0.116E+02
DAV: 4 -0.432310734984E+03 -0.71175E+02 -0.70926E+02 309 0.504E+01
DAV: 5 -0.433929823571E+03 -0.16191E+01 -0.16159E+01 318 0.785E+00 0.425E+01
DAV: 6 -0.388370874935E+03 0.45559E+02 -0.14836E+02 309 0.287E+01 0.208E+01
DAV: 7 -0.384981382310E+03 0.33895E+01 -0.12916E+01 345 0.773E+00 0.104E+01
DAV: 8 -0.383517558125E+03 0.14638E+01 -0.22637E+00 336 0.386E+00 0.431E+00
DAV: 9 -0.382948090059E+03 0.56947E+00 -0.62374E-01 336 0.206E+00 0.103E+00
DAV: 10 -0.382894839555E+03 0.53251E-01 -0.24831E-01 336 0.105E+00 0.942E-01
DAV: 11 -0.382872821410E+03 0.22018E-01 -0.80298E-02 345 0.548E-01 0.655E-01
DAV: 12 -0.382852818942E+03 0.20002E-01 -0.33509E-02 336 0.430E-01 0.480E-01
DAV: 13 -0.382833606180E+03 0.19213E-01 -0.21408E-02 318 0.467E-01 0.307E-01
DAV: 14 -0.382829494474E+03 0.41117E-02 -0.13841E-02 336 0.361E-01 0.166E-01
DAV: 15 -0.382834673146E+03 -0.51787E-02 -0.68472E-03 291 0.291E-01 0.133E-01
DAV: 16 -0.382843632744E+03 -0.89596E-02 -0.39772E-03 327 0.212E-01 0.113E-01
DAV: 17 -0.382852289628E+03 -0.86569E-02 -0.23501E-03 309 0.146E-01 0.789E-02
DAV: 18 -0.382860922615E+03 -0.86330E-02 -0.13291E-03 318 0.102E-01 0.451E-02
DAV: 19 -0.382869308722E+03 -0.83861E-02 -0.67535E-04 327 0.753E-02 0.312E-02
DAV: 20 -0.382875375693E+03 -0.60670E-02 -0.35207E-04 309 0.439E-02 0.251E-02
DAV: 21 -0.382879089579E+03 -0.37139E-02 -0.18811E-04 345 0.312E-02 0.123E-02
DAV: 22 -0.382881730116E+03 -0.26405E-02 -0.15420E-04 291 0.242E-02 0.121E-02
DAV: 23 -0.382882718308E+03 -0.98819E-03 -0.37631E-05 282 0.134E-02 0.745E-03
DAV: 24 -0.382883422209E+03 -0.70390E-03 -0.53784E-05 282 0.177E-02 0.843E-03
DAV: 25 -0.382883555622E+03 -0.13341E-03 -0.40329E-06 237 0.866E-03 0.522E-03
DAV: 26 -0.382883702410E+03 -0.14679E-03 -0.12272E-05 201 0.868E-03 0.281E-03
DAV: 27 -0.382883773705E+03 -0.71295E-04 -0.15909E-06 228 0.408E-03 0.156E-03
DAV: 28 -0.382883858820E+03 -0.85115E-04 -0.32435E-06 201 0.440E-03 0.164E-03
DAV: 29 -0.382883895208E+03 -0.36388E-04 -0.12254E-06 210 0.233E-03 0.152E-03
DAV: 30 -0.382883911469E+03 -0.16261E-04 -0.86614E-07 201 0.259E-03 0.435E-04
DAV: 31 -0.382883919627E+03 -0.81583E-05 -0.65873E-07 228 0.209E-03
1 F= -.38288392E+03 E0= -.38290137E+03 d E =0.523647E-01