iterations/neb0_image01_iter10_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 0.144729565621E+04 0.14473E+04 -0.44194E+04 330 0.697E+02
DAV: 2 0.224189701833E+03 -0.12231E+04 -0.11459E+04 435 0.163E+02
DAV: 3 -0.363093359340E+03 -0.58728E+03 -0.58385E+03 345 0.114E+02
DAV: 4 -0.433528123080E+03 -0.70435E+02 -0.70159E+02 318 0.508E+01
DAV: 5 -0.435100380716E+03 -0.15723E+01 -0.15698E+01 318 0.779E+00 0.426E+01
DAV: 6 -0.389103893315E+03 0.45996E+02 -0.14808E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385626864539E+03 0.34770E+01 -0.13428E+01 345 0.779E+00 0.104E+01
DAV: 8 -0.384149118288E+03 0.14777E+01 -0.20691E+00 327 0.380E+00 0.431E+00
DAV: 9 -0.383602351625E+03 0.54677E+00 -0.15542E+00 336 0.238E+00 0.136E+00
DAV: 10 -0.383546330721E+03 0.56021E-01 -0.44742E-01 318 0.115E+00 0.992E-01
DAV: 11 -0.383508014998E+03 0.38316E-01 -0.99882E-02 345 0.628E-01 0.774E-01
DAV: 12 -0.383494501763E+03 0.13513E-01 -0.10936E-01 345 0.704E-01 0.980E-01
DAV: 13 -0.383476189856E+03 0.18312E-01 -0.18455E-01 363 0.532E-01 0.691E-01
DAV: 14 -0.383464069930E+03 0.12120E-01 -0.60517E-02 327 0.391E-01 0.309E-01
DAV: 15 -0.383461893503E+03 0.21764E-02 -0.13089E-02 309 0.372E-01 0.254E-01
DAV: 16 -0.383467147344E+03 -0.52538E-02 -0.68405E-03 336 0.253E-01 0.250E-01
DAV: 17 -0.383473157272E+03 -0.60099E-02 -0.35838E-03 300 0.183E-01 0.205E-01
DAV: 18 -0.383483489495E+03 -0.10332E-01 -0.73405E-03 363 0.233E-01 0.234E-01
DAV: 19 -0.383485228961E+03 -0.17395E-02 -0.18302E-03 318 0.109E-01 0.150E-01
DAV: 20 -0.383490073186E+03 -0.48442E-02 -0.79448E-04 282 0.686E-02 0.108E-01
DAV: 21 -0.383497783263E+03 -0.77101E-02 -0.10124E-03 309 0.845E-02 0.953E-02
DAV: 22 -0.383501956416E+03 -0.41732E-02 -0.60169E-04 327 0.538E-02 0.607E-02
DAV: 23 -0.383506361867E+03 -0.44055E-02 -0.25772E-04 309 0.454E-02 0.384E-02
DAV: 24 -0.383509243615E+03 -0.28817E-02 -0.20752E-04 318 0.289E-02 0.447E-02
DAV: 25 -0.383511096134E+03 -0.18525E-02 -0.10218E-04 318 0.228E-02 0.158E-02
DAV: 26 -0.383512342097E+03 -0.12460E-02 -0.74072E-05 309 0.177E-02 0.121E-02
DAV: 27 -0.383512929878E+03 -0.58778E-03 -0.21393E-05 255 0.104E-02 0.105E-02
DAV: 28 -0.383513239120E+03 -0.30924E-03 -0.11476E-05 237 0.707E-03 0.513E-03
DAV: 29 -0.383513473652E+03 -0.23453E-03 -0.95454E-06 228 0.643E-03 0.450E-03
DAV: 30 -0.383513539079E+03 -0.65427E-04 -0.25802E-06 228 0.357E-03 0.271E-03
DAV: 31 -0.383513568488E+03 -0.29409E-04 -0.10552E-06 228 0.239E-03 0.171E-03
DAV: 32 -0.383513623148E+03 -0.54661E-04 -0.23544E-06 201 0.370E-03 0.176E-03
DAV: 33 -0.383513629854E+03 -0.67057E-05 -0.63492E-07 237 0.179E-03
1 F= -.38351363E+03 E0= -.38353029E+03 d E =0.499782E-01