iterations/neb0_image01_iter7_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 0.144729263038E+04 0.14473E+04 -0.44194E+04 330 0.697E+02
DAV: 2 0.224185314142E+03 -0.12231E+04 -0.11459E+04 435 0.163E+02
DAV: 3 -0.363094227435E+03 -0.58728E+03 -0.58384E+03 345 0.114E+02
DAV: 4 -0.433528181698E+03 -0.70434E+02 -0.70158E+02 318 0.508E+01
DAV: 5 -0.435100424649E+03 -0.15722E+01 -0.15697E+01 318 0.779E+00 0.426E+01
DAV: 6 -0.389103755407E+03 0.45997E+02 -0.14809E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385627152284E+03 0.34766E+01 -0.13440E+01 345 0.779E+00 0.104E+01
DAV: 8 -0.384148797864E+03 0.14784E+01 -0.20623E+00 327 0.380E+00 0.431E+00
DAV: 9 -0.383602053264E+03 0.54674E+00 -0.15553E+00 336 0.238E+00 0.136E+00
DAV: 10 -0.383546634873E+03 0.55418E-01 -0.45271E-01 318 0.115E+00 0.986E-01
DAV: 11 -0.383507590043E+03 0.39045E-01 -0.92489E-02 345 0.628E-01 0.755E-01
DAV: 12 -0.383494078002E+03 0.13512E-01 -0.91565E-02 345 0.704E-01 0.997E-01
DAV: 13 -0.383474910673E+03 0.19167E-01 -0.18231E-01 363 0.530E-01 0.667E-01
DAV: 14 -0.383464112320E+03 0.10798E-01 -0.56285E-02 336 0.387E-01 0.308E-01
DAV: 15 -0.383461519359E+03 0.25930E-02 -0.11684E-02 309 0.367E-01 0.210E-01
DAV: 16 -0.383467734102E+03 -0.62147E-02 -0.68811E-03 318 0.252E-01 0.220E-01
DAV: 17 -0.383475822523E+03 -0.80884E-02 -0.39205E-03 345 0.231E-01 0.176E-01
DAV: 18 -0.383484863444E+03 -0.90409E-02 -0.48331E-03 318 0.176E-01 0.216E-01
DAV: 19 -0.383484255414E+03 0.60803E-03 -0.96002E-04 336 0.790E-02 0.126E-01
DAV: 20 -0.383489799766E+03 -0.55444E-02 -0.45095E-04 291 0.538E-02 0.110E-01
DAV: 21 -0.383498020484E+03 -0.82207E-02 -0.86390E-04 300 0.793E-02 0.963E-02
DAV: 22 -0.383504568675E+03 -0.65482E-02 -0.89286E-04 345 0.692E-02 0.412E-02
DAV: 23 -0.383506811414E+03 -0.22427E-02 -0.17459E-04 318 0.289E-02 0.448E-02
DAV: 24 -0.383508986286E+03 -0.21749E-02 -0.10116E-04 300 0.209E-02 0.193E-02
DAV: 25 -0.383511335501E+03 -0.23492E-02 -0.14691E-04 336 0.237E-02 0.235E-02
DAV: 26 -0.383512141305E+03 -0.80580E-03 -0.40619E-05 291 0.145E-02 0.194E-02
DAV: 27 -0.383512668208E+03 -0.52690E-03 -0.26253E-05 273 0.131E-02 0.118E-02
DAV: 28 -0.383513041195E+03 -0.37299E-03 -0.17329E-05 246 0.899E-03 0.969E-03
DAV: 29 -0.383513171901E+03 -0.13071E-03 -0.83781E-06 246 0.868E-03 0.544E-03
DAV: 30 -0.383513341848E+03 -0.16995E-03 -0.43875E-06 201 0.522E-03 0.311E-03
DAV: 31 -0.383513431706E+03 -0.89858E-04 -0.41975E-06 219 0.381E-03 0.296E-03
DAV: 32 -0.383513483555E+03 -0.51849E-04 -0.15745E-06 219 0.271E-03 0.222E-03
DAV: 33 -0.383513513814E+03 -0.30259E-04 -0.16286E-06 219 0.327E-03 0.210E-03
DAV: 34 -0.383513523890E+03 -0.10076E-04 -0.77057E-07 228 0.209E-03 0.144E-03
DAV: 35 -0.383513531912E+03 -0.80214E-05 -0.35865E-07 201 0.116E-03
1 F= -.38351353E+03 E0= -.38353019E+03 d E =0.499843E-01