iterations/neb0_image03_iter67_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 0.144940304667E+04 0.14494E+04 -0.44200E+04 330 0.697E+02
DAV: 2 0.224678429114E+03 -0.12247E+04 -0.11489E+04 435 0.163E+02
DAV: 3 -0.362580210079E+03 -0.58726E+03 -0.58370E+03 345 0.114E+02
DAV: 4 -0.433510894889E+03 -0.70931E+02 -0.70684E+02 318 0.509E+01
DAV: 5 -0.435097616622E+03 -0.15867E+01 -0.15843E+01 318 0.784E+00 0.427E+01
DAV: 6 -0.389038688317E+03 0.46059E+02 -0.14834E+02 309 0.286E+01 0.208E+01
DAV: 7 -0.385557090691E+03 0.34816E+01 -0.13392E+01 345 0.779E+00 0.104E+01
DAV: 8 -0.384081710189E+03 0.14754E+01 -0.21256E+00 336 0.382E+00 0.430E+00
DAV: 9 -0.383517414503E+03 0.56430E+00 -0.94397E-01 327 0.217E+00 0.117E+00
DAV: 10 -0.383471305085E+03 0.46109E-01 -0.47957E-01 327 0.110E+00 0.949E-01
DAV: 11 -0.383433738018E+03 0.37567E-01 -0.78997E-02 327 0.593E-01 0.599E-01
DAV: 12 -0.383408501313E+03 0.25237E-01 -0.36332E-02 327 0.474E-01 0.404E-01
DAV: 13 -0.383396769439E+03 0.11732E-01 -0.17702E-02 345 0.449E-01 0.566E-01
DAV: 14 -0.383393604258E+03 0.31652E-02 -0.10399E-02 345 0.277E-01 0.244E-01
DAV: 15 -0.383396675998E+03 -0.30717E-02 -0.30783E-02 318 0.306E-01 0.406E-01
DAV: 16 -0.383399192532E+03 -0.25165E-02 -0.27962E-02 318 0.227E-01 0.155E-01
DAV: 17 -0.383408535262E+03 -0.93427E-02 -0.30443E-03 300 0.172E-01 0.922E-02
DAV: 18 -0.383421585782E+03 -0.13051E-01 -0.32669E-03 309 0.176E-01 0.714E-02
DAV: 19 -0.383429819523E+03 -0.82337E-02 -0.13310E-03 309 0.111E-01 0.460E-02
DAV: 20 -0.383434613079E+03 -0.47936E-02 -0.36990E-04 318 0.465E-02 0.374E-02
DAV: 21 -0.383440565801E+03 -0.59527E-02 -0.31971E-04 300 0.341E-02 0.360E-02
DAV: 22 -0.383444295332E+03 -0.37295E-02 -0.23141E-04 309 0.302E-02 0.106E-02
DAV: 23 -0.383446462026E+03 -0.21667E-02 -0.12520E-04 300 0.209E-02 0.139E-02
DAV: 24 -0.383447139329E+03 -0.67730E-03 -0.18539E-05 255 0.871E-03 0.656E-03
DAV: 25 -0.383447789296E+03 -0.64997E-03 -0.40627E-05 273 0.115E-02 0.561E-03
DAV: 26 -0.383447915658E+03 -0.12636E-03 -0.29256E-06 237 0.454E-03 0.432E-03
DAV: 27 -0.383448046965E+03 -0.13131E-03 -0.38655E-06 192 0.451E-03 0.305E-03
DAV: 28 -0.383448117875E+03 -0.70910E-04 -0.25763E-06 228 0.423E-03 0.285E-03
DAV: 29 -0.383448137793E+03 -0.19918E-04 -0.10135E-06 237 0.296E-03 0.179E-03
DAV: 30 -0.383448166706E+03 -0.28913E-04 -0.10903E-06 201 0.236E-03 0.113E-03
DAV: 31 -0.383448174475E+03 -0.77688E-05 -0.29959E-07 228 0.121E-03
1 F= -.38344817E+03 E0= -.38346071E+03 d E =0.376193E-01