iterations/neb0_image08_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 0.145375868246E+04 0.14538E+04 -0.44266E+04 330 0.697E+02
DAV: 2 0.230518743487E+03 -0.12232E+04 -0.11477E+04 426 0.163E+02
DAV: 3 -0.360445130990E+03 -0.59096E+03 -0.58757E+03 345 0.114E+02
DAV: 4 -0.432772390469E+03 -0.72327E+02 -0.72041E+02 318 0.513E+01
DAV: 5 -0.434415303461E+03 -0.16429E+01 -0.16401E+01 318 0.797E+00 0.428E+01
DAV: 6 -0.388486665326E+03 0.45929E+02 -0.14742E+02 309 0.286E+01 0.209E+01
DAV: 7 -0.385009010049E+03 0.34777E+01 -0.13466E+01 336 0.788E+00 0.104E+01
DAV: 8 -0.383584288873E+03 0.14247E+01 -0.29791E+00 345 0.404E+00 0.441E+00
DAV: 9 -0.383056302093E+03 0.52799E+00 -0.13912E+00 336 0.237E+00 0.139E+00
DAV: 10 -0.382953148082E+03 0.10315E+00 -0.20202E-01 327 0.121E+00 0.103E+00
DAV: 11 -0.382941427107E+03 0.11721E-01 -0.16046E-01 336 0.916E-01 0.893E-01
DAV: 12 -0.382914639825E+03 0.26787E-01 -0.10972E-01 327 0.538E-01 0.800E-01
DAV: 13 -0.382908018950E+03 0.66209E-02 -0.10438E-01 372 0.374E-01 0.596E-01
DAV: 14 -0.382897034782E+03 0.10984E-01 -0.44789E-02 318 0.449E-01 0.842E-01
DAV: 15 -0.382887241083E+03 0.97937E-02 -0.24724E-02 363 0.471E-01 0.669E-01
DAV: 16 -0.382883768469E+03 0.34726E-02 -0.37669E-02 318 0.340E-01 0.235E-01
DAV: 17 -0.382888867278E+03 -0.50988E-02 -0.94509E-03 309 0.229E-01 0.312E-01
DAV: 18 -0.382896682293E+03 -0.78150E-02 -0.31283E-03 291 0.227E-01 0.157E-01
DAV: 19 -0.382906569502E+03 -0.98872E-02 -0.65122E-03 336 0.206E-01 0.114E-01
DAV: 20 -0.382914807741E+03 -0.82382E-02 -0.18053E-03 300 0.121E-01 0.189E-01
DAV: 21 -0.382919876207E+03 -0.50685E-02 -0.88529E-04 318 0.694E-02 0.518E-02
DAV: 22 -0.382925973756E+03 -0.60975E-02 -0.49772E-04 282 0.511E-02 0.368E-02
DAV: 23 -0.382929668733E+03 -0.36950E-02 -0.19595E-04 318 0.317E-02 0.231E-02
DAV: 24 -0.382932869664E+03 -0.32009E-02 -0.17972E-04 291 0.238E-02 0.261E-02
DAV: 25 -0.382934123538E+03 -0.12539E-02 -0.70645E-05 300 0.138E-02 0.883E-03
DAV: 26 -0.382935038103E+03 -0.91457E-03 -0.54462E-05 273 0.129E-02 0.774E-03
DAV: 27 -0.382935261802E+03 -0.22370E-03 -0.59547E-06 228 0.578E-03 0.782E-03
DAV: 28 -0.382935444813E+03 -0.18301E-03 -0.96955E-06 219 0.579E-03 0.305E-03
DAV: 29 -0.382935498569E+03 -0.53756E-04 -0.18130E-06 228 0.327E-03 0.224E-03
DAV: 30 -0.382935546239E+03 -0.47670E-04 -0.16697E-06 192 0.279E-03 0.243E-03
DAV: 31 -0.382935575770E+03 -0.29531E-04 -0.98922E-07 219 0.209E-03 0.199E-03
DAV: 32 -0.382935591093E+03 -0.15322E-04 -0.58720E-07 201 0.158E-03 0.139E-03
DAV: 33 -0.382935600155E+03 -0.90620E-05 -0.38158E-07 219 0.122E-03
1 F= -.38293560E+03 E0= -.38295231E+03 d E =0.501443E-01