iterations/neb0_image09_iter21_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 0.145470358159E+04 0.14547E+04 -0.44275E+04 330 0.697E+02
DAV: 2 0.231606611205E+03 -0.12231E+04 -0.11488E+04 426 0.163E+02
DAV: 3 -0.362130066980E+03 -0.59374E+03 -0.58955E+03 354 0.114E+02
DAV: 4 -0.432779779047E+03 -0.70650E+02 -0.70367E+02 318 0.497E+01
DAV: 5 -0.434361062669E+03 -0.15813E+01 -0.15784E+01 327 0.777E+00 0.428E+01
DAV: 6 -0.388373281177E+03 0.45988E+02 -0.14884E+02 309 0.287E+01 0.209E+01
DAV: 7 -0.384910545568E+03 0.34627E+01 -0.12860E+01 345 0.783E+00 0.104E+01
DAV: 8 -0.383451460863E+03 0.14591E+01 -0.18631E+00 345 0.384E+00 0.427E+00
DAV: 9 -0.382905836120E+03 0.54562E+00 -0.11684E+00 327 0.214E+00 0.986E-01
DAV: 10 -0.382846038562E+03 0.59798E-01 -0.11601E-01 327 0.952E-01 0.788E-01
DAV: 11 -0.382803593801E+03 0.42445E-01 -0.72218E-02 345 0.697E-01 0.487E-01
DAV: 12 -0.382780914621E+03 0.22679E-01 -0.27078E-02 336 0.480E-01 0.456E-01
DAV: 13 -0.382776136122E+03 0.47785E-02 -0.31770E-02 354 0.434E-01 0.357E-01
DAV: 14 -0.382770658890E+03 0.54772E-02 -0.20120E-02 309 0.375E-01 0.211E-01
DAV: 15 -0.382777313475E+03 -0.66546E-02 -0.64202E-03 309 0.227E-01 0.114E-01
DAV: 16 -0.382785938267E+03 -0.86248E-02 -0.28816E-03 300 0.187E-01 0.776E-02
DAV: 17 -0.382798708271E+03 -0.12770E-01 -0.31086E-03 300 0.179E-01 0.523E-02
DAV: 18 -0.382804941249E+03 -0.62330E-02 -0.11322E-03 336 0.963E-02 0.472E-02
DAV: 19 -0.382809621887E+03 -0.46806E-02 -0.20908E-04 318 0.345E-02 0.383E-02
DAV: 20 -0.382817343415E+03 -0.77215E-02 -0.61115E-04 291 0.464E-02 0.367E-02
DAV: 21 -0.382820295657E+03 -0.29522E-02 -0.17878E-04 336 0.283E-02 0.217E-02
DAV: 22 -0.382821953111E+03 -0.16575E-02 -0.15462E-04 300 0.275E-02 0.255E-02
DAV: 23 -0.382822509842E+03 -0.55673E-03 -0.25583E-05 282 0.133E-02 0.175E-02
DAV: 24 -0.382823173750E+03 -0.66391E-03 -0.25964E-05 237 0.975E-03 0.961E-03
DAV: 25 -0.382823723916E+03 -0.55017E-03 -0.21430E-05 237 0.951E-03 0.344E-03
DAV: 26 -0.382823920979E+03 -0.19706E-03 -0.71954E-06 219 0.601E-03 0.299E-03
DAV: 27 -0.382824026418E+03 -0.10544E-03 -0.28058E-06 210 0.387E-03 0.259E-03
DAV: 28 -0.382824118830E+03 -0.92412E-04 -0.38530E-06 201 0.384E-03 0.129E-03
DAV: 29 -0.382824140105E+03 -0.21275E-04 -0.13179E-06 228 0.254E-03 0.114E-03
DAV: 30 -0.382824158574E+03 -0.18469E-04 -0.97004E-07 192 0.214E-03 0.971E-04
DAV: 31 -0.382824167309E+03 -0.87349E-05 -0.38236E-07 228 0.136E-03
1 F= -.38282417E+03 E0= -.38283755E+03 d E =0.401457E-01