iterations/neb0_image01_iter8_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 0.144730575529E+04 0.14473E+04 -0.44194E+04 330 0.697E+02
DAV: 2 0.224193578281E+03 -0.12231E+04 -0.11459E+04 435 0.163E+02
DAV: 3 -0.363094993475E+03 -0.58729E+03 -0.58385E+03 345 0.114E+02
DAV: 4 -0.433530512253E+03 -0.70436E+02 -0.70159E+02 318 0.508E+01
DAV: 5 -0.435102809220E+03 -0.15723E+01 -0.15698E+01 318 0.779E+00 0.426E+01
DAV: 6 -0.389104128415E+03 0.45999E+02 -0.14809E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385626349429E+03 0.34778E+01 -0.13403E+01 345 0.779E+00 0.104E+01
DAV: 8 -0.384148155381E+03 0.14782E+01 -0.20541E+00 327 0.380E+00 0.431E+00
DAV: 9 -0.383598941248E+03 0.54921E+00 -0.14700E+00 336 0.235E+00 0.133E+00
DAV: 10 -0.383545887700E+03 0.53054E-01 -0.44630E-01 318 0.114E+00 0.976E-01
DAV: 11 -0.383506365422E+03 0.39522E-01 -0.82493E-02 345 0.624E-01 0.728E-01
DAV: 12 -0.383494366917E+03 0.11999E-01 -0.70943E-02 354 0.698E-01 0.103E+00
DAV: 13 -0.383472756715E+03 0.21610E-01 -0.16578E-01 354 0.517E-01 0.604E-01
DAV: 14 -0.383464364093E+03 0.83926E-02 -0.52524E-02 327 0.385E-01 0.354E-01
DAV: 15 -0.383461459225E+03 0.29049E-02 -0.14924E-02 318 0.375E-01 0.259E-01
DAV: 16 -0.383466353514E+03 -0.48943E-02 -0.77664E-03 309 0.246E-01 0.227E-01
DAV: 17 -0.383474609371E+03 -0.82559E-02 -0.48181E-03 354 0.221E-01 0.127E-01
DAV: 18 -0.383480813613E+03 -0.62042E-02 -0.21787E-03 300 0.126E-01 0.127E-01
DAV: 19 -0.383486327854E+03 -0.55142E-02 -0.32195E-03 363 0.105E-01 0.843E-02
DAV: 20 -0.383494305493E+03 -0.79776E-02 -0.34968E-03 300 0.118E-01 0.148E-01
DAV: 21 -0.383497208996E+03 -0.29035E-02 -0.29419E-04 318 0.559E-02 0.592E-02
DAV: 22 -0.383504587015E+03 -0.73780E-02 -0.78535E-04 282 0.553E-02 0.385E-02
DAV: 23 -0.383507619967E+03 -0.30330E-02 -0.17678E-04 336 0.308E-02 0.261E-02
DAV: 24 -0.383509807618E+03 -0.21877E-02 -0.10682E-04 309 0.210E-02 0.200E-02
DAV: 25 -0.383511701618E+03 -0.18940E-02 -0.86558E-05 300 0.187E-02 0.805E-03
DAV: 26 -0.383512590757E+03 -0.88914E-03 -0.38907E-05 291 0.112E-02 0.659E-03
DAV: 27 -0.383512991348E+03 -0.40059E-03 -0.13038E-05 246 0.736E-03 0.487E-03
DAV: 28 -0.383513313051E+03 -0.32170E-03 -0.15333E-05 228 0.654E-03 0.449E-03
DAV: 29 -0.383513379421E+03 -0.66370E-04 -0.16472E-06 228 0.296E-03 0.283E-03
DAV: 30 -0.383513442336E+03 -0.62914E-04 -0.19706E-06 201 0.330E-03 0.140E-03
DAV: 31 -0.383513476788E+03 -0.34452E-04 -0.10419E-06 219 0.211E-03 0.125E-03
DAV: 32 -0.383513496833E+03 -0.20045E-04 -0.67744E-07 219 0.167E-03 0.115E-03
DAV: 33 -0.383513510496E+03 -0.13664E-04 -0.66165E-07 201 0.175E-03 0.644E-04
DAV: 34 -0.383513513327E+03 -0.28305E-05 -0.20699E-07 228 0.997E-04
1 F= -.38351351E+03 E0= -.38353017E+03 d E =0.499731E-01