iterations/neb0_image05_iter57_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 0.144845435725E+04 0.14485E+04 -0.44228E+04 330 0.697E+02
DAV: 2 0.231020188668E+03 -0.12174E+04 -0.11404E+04 417 0.163E+02
DAV: 3 -0.364235367062E+03 -0.59526E+03 -0.59206E+03 354 0.114E+02
DAV: 4 -0.433276067490E+03 -0.69041E+02 -0.68786E+02 309 0.497E+01
DAV: 5 -0.434839258405E+03 -0.15632E+01 -0.15604E+01 327 0.771E+00 0.427E+01
DAV: 6 -0.388833562136E+03 0.46006E+02 -0.14949E+02 309 0.287E+01 0.209E+01
DAV: 7 -0.385354734866E+03 0.34788E+01 -0.13231E+01 345 0.777E+00 0.104E+01
DAV: 8 -0.383871237203E+03 0.14835E+01 -0.18452E+00 327 0.379E+00 0.430E+00
DAV: 9 -0.383333336690E+03 0.53790E+00 -0.11950E+00 336 0.206E+00 0.103E+00
DAV: 10 -0.383260915446E+03 0.72421E-01 -0.95117E-02 336 0.882E-01 0.103E+00
DAV: 11 -0.383249107712E+03 0.11808E-01 -0.28827E-01 336 0.683E-01 0.990E-01
DAV: 12 -0.383218079524E+03 0.31028E-01 -0.26259E-02 318 0.447E-01 0.760E-01
DAV: 13 -0.383200782766E+03 0.17297E-01 -0.58316E-02 318 0.437E-01 0.583E-01
DAV: 14 -0.383191109416E+03 0.96734E-02 -0.19537E-02 318 0.412E-01 0.443E-01
DAV: 15 -0.383191147331E+03 -0.37915E-04 -0.23714E-02 327 0.272E-01 0.186E-01
DAV: 16 -0.383199351410E+03 -0.82041E-02 -0.48175E-03 291 0.196E-01 0.192E-01
DAV: 17 -0.383209390538E+03 -0.10039E-01 -0.72195E-03 300 0.213E-01 0.136E-01
DAV: 18 -0.383218482431E+03 -0.90919E-02 -0.25306E-03 336 0.141E-01 0.776E-02
DAV: 19 -0.383224212141E+03 -0.57297E-02 -0.50784E-04 309 0.638E-02 0.759E-02
DAV: 20 -0.383233471809E+03 -0.92597E-02 -0.57324E-04 282 0.515E-02 0.468E-02
DAV: 21 -0.383238431486E+03 -0.49597E-02 -0.37563E-04 354 0.424E-02 0.357E-02
DAV: 22 -0.383241212763E+03 -0.27813E-02 -0.19606E-04 318 0.337E-02 0.218E-02
DAV: 23 -0.383242540235E+03 -0.13275E-02 -0.39488E-05 309 0.142E-02 0.165E-02
DAV: 24 -0.383244794229E+03 -0.22540E-02 -0.14799E-04 282 0.213E-02 0.124E-02
DAV: 25 -0.383245357969E+03 -0.56374E-03 -0.25602E-05 255 0.105E-02 0.586E-03
DAV: 26 -0.383245708555E+03 -0.35059E-03 -0.99219E-06 201 0.664E-03 0.498E-03
DAV: 27 -0.383245889498E+03 -0.18094E-03 -0.57066E-06 228 0.470E-03 0.234E-03
DAV: 28 -0.383246033738E+03 -0.14424E-03 -0.45671E-06 192 0.408E-03 0.193E-03
DAV: 29 -0.383246085836E+03 -0.52098E-04 -0.20549E-06 228 0.305E-03 0.131E-03
DAV: 30 -0.383246131516E+03 -0.45680E-04 -0.22511E-06 192 0.303E-03 0.181E-03
DAV: 31 -0.383246141180E+03 -0.96647E-05 -0.71531E-07 219 0.192E-03
1 F= -.38324614E+03 E0= -.38326294E+03 d E =0.503856E-01