iterations/neb0_image09_iter6_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 0.145234824766E+04 0.14523E+04 -0.44262E+04 330 0.697E+02
DAV: 2 0.240288000740E+03 -0.12121E+04 -0.11377E+04 408 0.163E+02
DAV: 3 -0.360811401050E+03 -0.60110E+03 -0.59763E+03 363 0.116E+02
DAV: 4 -0.431665279883E+03 -0.70854E+02 -0.70557E+02 318 0.498E+01
DAV: 5 -0.433238352463E+03 -0.15731E+01 -0.15700E+01 318 0.771E+00 0.427E+01
DAV: 6 -0.387720713288E+03 0.45518E+02 -0.14703E+02 309 0.286E+01 0.208E+01
DAV: 7 -0.384285134106E+03 0.34356E+01 -0.12793E+01 336 0.784E+00 0.104E+01
DAV: 8 -0.382856508967E+03 0.14286E+01 -0.24588E+00 336 0.396E+00 0.434E+00
DAV: 9 -0.382306486151E+03 0.55002E+00 -0.13183E+00 336 0.235E+00 0.123E+00
DAV: 10 -0.382241703880E+03 0.64782E-01 -0.16920E-01 336 0.117E+00 0.108E+00
DAV: 11 -0.382223020842E+03 0.18683E-01 -0.28973E-01 345 0.637E-01 0.791E-01
DAV: 12 -0.382187029221E+03 0.35992E-01 -0.44544E-02 345 0.573E-01 0.576E-01
DAV: 13 -0.382176176217E+03 0.10853E-01 -0.61316E-02 363 0.495E-01 0.577E-01
DAV: 14 -0.382171522530E+03 0.46537E-02 -0.28258E-02 327 0.403E-01 0.648E-01
DAV: 15 -0.382166812107E+03 0.47104E-02 -0.55717E-02 336 0.313E-01 0.284E-01
DAV: 16 -0.382171661878E+03 -0.48498E-02 -0.15358E-02 327 0.279E-01 0.235E-01
DAV: 17 -0.382176104294E+03 -0.44424E-02 -0.66724E-03 291 0.238E-01 0.141E-01
DAV: 18 -0.382188529831E+03 -0.12426E-01 -0.65607E-03 327 0.213E-01 0.216E-01
DAV: 19 -0.382196718173E+03 -0.81883E-02 -0.39171E-03 309 0.184E-01 0.150E-01
DAV: 20 -0.382201748610E+03 -0.50304E-02 -0.13002E-03 318 0.102E-01 0.522E-02
DAV: 21 -0.382206046733E+03 -0.42981E-02 -0.35727E-04 327 0.448E-02 0.334E-02
DAV: 22 -0.382211744017E+03 -0.56973E-02 -0.45636E-04 300 0.469E-02 0.616E-02
DAV: 23 -0.382214227620E+03 -0.24836E-02 -0.25405E-04 336 0.357E-02 0.175E-02
DAV: 24 -0.382216172529E+03 -0.19449E-02 -0.13157E-04 282 0.236E-02 0.133E-02
DAV: 25 -0.382217233890E+03 -0.10614E-02 -0.47299E-05 291 0.137E-02 0.995E-03
DAV: 26 -0.382217756553E+03 -0.52266E-03 -0.11864E-05 219 0.895E-03 0.436E-03
DAV: 27 -0.382218276858E+03 -0.52030E-03 -0.31414E-05 255 0.104E-02 0.497E-03
DAV: 28 -0.382218369334E+03 -0.92477E-04 -0.21909E-06 246 0.554E-03 0.290E-03
DAV: 29 -0.382218495772E+03 -0.12644E-03 -0.76289E-06 192 0.693E-03 0.349E-03
DAV: 30 -0.382218529625E+03 -0.33853E-04 -0.14828E-06 228 0.347E-03 0.373E-03
DAV: 31 -0.382218567185E+03 -0.37559E-04 -0.19303E-06 192 0.406E-03 0.254E-03
DAV: 32 -0.382218590581E+03 -0.23396E-04 -0.13627E-06 219 0.302E-03 0.132E-03
DAV: 33 -0.382218602271E+03 -0.11690E-04 -0.68818E-07 210 0.186E-03 0.173E-03
DAV: 34 -0.382218606475E+03 -0.42040E-05 -0.21079E-07 237 0.127E-03
1 F= -.38221861E+03 E0= -.38223535E+03 d E =0.502229E-01