iterations/neb0_image02_iter56_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 0.144770642380E+04 0.14477E+04 -0.44194E+04 330 0.697E+02
DAV: 2 0.224133798654E+03 -0.12236E+04 -0.11466E+04 435 0.163E+02
DAV: 3 -0.363075545675E+03 -0.58721E+03 -0.58413E+03 345 0.114E+02
DAV: 4 -0.433457458482E+03 -0.70382E+02 -0.70136E+02 309 0.508E+01
DAV: 5 -0.435035332785E+03 -0.15779E+01 -0.15753E+01 327 0.780E+00 0.426E+01
DAV: 6 -0.389059038064E+03 0.45976E+02 -0.14822E+02 309 0.286E+01 0.208E+01
DAV: 7 -0.385579199302E+03 0.34798E+01 -0.13402E+01 345 0.776E+00 0.104E+01
DAV: 8 -0.384105053847E+03 0.14741E+01 -0.21105E+00 327 0.381E+00 0.438E+00
DAV: 9 -0.383555669549E+03 0.54938E+00 -0.16319E+00 354 0.236E+00 0.133E+00
DAV: 10 -0.383487814806E+03 0.67855E-01 -0.34783E-01 327 0.115E+00 0.104E+00
DAV: 11 -0.383457148043E+03 0.30667E-01 -0.73902E-02 336 0.625E-01 0.751E-01
DAV: 12 -0.383427741226E+03 0.29407E-01 -0.52862E-02 363 0.646E-01 0.584E-01
DAV: 13 -0.383415246054E+03 0.12495E-01 -0.53897E-02 318 0.393E-01 0.610E-01
DAV: 14 -0.383412411500E+03 0.28346E-02 -0.42390E-02 363 0.392E-01 0.611E-01
DAV: 15 -0.383405403277E+03 0.70082E-02 -0.41856E-02 318 0.322E-01 0.281E-01
DAV: 16 -0.383409269785E+03 -0.38665E-02 -0.12454E-02 309 0.316E-01 0.294E-01
DAV: 17 -0.383414829559E+03 -0.55598E-02 -0.65493E-03 327 0.203E-01 0.159E-01
DAV: 18 -0.383426948864E+03 -0.12119E-01 -0.37630E-03 300 0.172E-01 0.196E-01
DAV: 19 -0.383435908136E+03 -0.89593E-02 -0.30904E-03 318 0.136E-01 0.700E-02
DAV: 20 -0.383441810756E+03 -0.59026E-02 -0.77189E-04 327 0.819E-02 0.126E-01
DAV: 21 -0.383446642936E+03 -0.48322E-02 -0.34294E-04 327 0.533E-02 0.488E-02
DAV: 22 -0.383450343877E+03 -0.37009E-02 -0.17375E-04 318 0.316E-02 0.287E-02
DAV: 23 -0.383455029293E+03 -0.46854E-02 -0.30371E-04 300 0.330E-02 0.204E-02
DAV: 24 -0.383456806491E+03 -0.17772E-02 -0.67125E-05 309 0.158E-02 0.194E-02
DAV: 25 -0.383458202570E+03 -0.13961E-02 -0.77212E-05 291 0.179E-02 0.143E-02
DAV: 26 -0.383458597088E+03 -0.39452E-03 -0.10486E-05 237 0.865E-03 0.851E-03
DAV: 27 -0.383458831516E+03 -0.23443E-03 -0.73750E-06 210 0.504E-03 0.403E-03
DAV: 28 -0.383459060361E+03 -0.22885E-03 -0.66628E-06 219 0.521E-03 0.194E-03
DAV: 29 -0.383459159288E+03 -0.98927E-04 -0.46067E-06 228 0.429E-03 0.237E-03
DAV: 30 -0.383459187345E+03 -0.28057E-04 -0.16601E-06 237 0.296E-03 0.181E-03
DAV: 31 -0.383459218675E+03 -0.31330E-04 -0.14772E-06 192 0.246E-03 0.179E-03
DAV: 32 -0.383459227187E+03 -0.85121E-05 -0.49843E-07 228 0.164E-03
1 F= -.38345923E+03 E0= -.38347531E+03 d E =0.482529E-01