iterations/neb0_image02_iter6_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 0.144806047803E+04 0.14481E+04 -0.44193E+04 330 0.697E+02
DAV: 2 0.224466806360E+03 -0.12236E+04 -0.11470E+04 435 0.163E+02
DAV: 3 -0.362852680227E+03 -0.58732E+03 -0.58419E+03 345 0.114E+02
DAV: 4 -0.433461500513E+03 -0.70609E+02 -0.70371E+02 309 0.508E+01
DAV: 5 -0.435045676345E+03 -0.15842E+01 -0.15816E+01 318 0.781E+00 0.426E+01
DAV: 6 -0.389085204872E+03 0.45960E+02 -0.14801E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385616539332E+03 0.34687E+01 -0.13328E+01 345 0.778E+00 0.104E+01
DAV: 8 -0.384136644056E+03 0.14799E+01 -0.19775E+00 336 0.379E+00 0.428E+00
DAV: 9 -0.383590377016E+03 0.54627E+00 -0.81979E-01 345 0.221E+00 0.126E+00
DAV: 10 -0.383536133359E+03 0.54244E-01 -0.45454E-01 327 0.103E+00 0.122E+00
DAV: 11 -0.383500698406E+03 0.35435E-01 -0.77822E-02 327 0.636E-01 0.723E-01
DAV: 12 -0.383479031646E+03 0.21667E-01 -0.24536E-02 327 0.428E-01 0.585E-01
DAV: 13 -0.383465809045E+03 0.13223E-01 -0.40050E-02 354 0.390E-01 0.493E-01
DAV: 14 -0.383456018725E+03 0.97903E-02 -0.12069E-02 318 0.372E-01 0.280E-01
DAV: 15 -0.383455249952E+03 0.76877E-03 -0.10771E-02 327 0.345E-01 0.391E-01
DAV: 16 -0.383458593684E+03 -0.33437E-02 -0.47290E-03 354 0.234E-01 0.137E-01
DAV: 17 -0.383470189874E+03 -0.11596E-01 -0.41790E-03 282 0.187E-01 0.115E-01
DAV: 18 -0.383479892440E+03 -0.97026E-02 -0.26406E-03 309 0.149E-01 0.798E-02
DAV: 19 -0.383489391948E+03 -0.94995E-02 -0.14168E-03 327 0.120E-01 0.568E-02
DAV: 20 -0.383497105635E+03 -0.77137E-02 -0.54815E-04 318 0.602E-02 0.429E-02
DAV: 21 -0.383501331696E+03 -0.42261E-02 -0.17935E-04 318 0.314E-02 0.372E-02
DAV: 22 -0.383504856548E+03 -0.35249E-02 -0.19657E-04 309 0.329E-02 0.166E-02
DAV: 23 -0.383507040910E+03 -0.21844E-02 -0.99105E-05 309 0.224E-02 0.238E-02
DAV: 24 -0.383508324956E+03 -0.12840E-02 -0.54476E-05 300 0.178E-02 0.105E-02
DAV: 25 -0.383509251163E+03 -0.92621E-03 -0.39627E-05 273 0.122E-02 0.647E-03
DAV: 26 -0.383509536900E+03 -0.28574E-03 -0.68227E-06 237 0.639E-03 0.399E-03
DAV: 27 -0.383509877094E+03 -0.34019E-03 -0.13961E-05 219 0.728E-03 0.363E-03
DAV: 28 -0.383509982968E+03 -0.10587E-03 -0.30322E-06 228 0.431E-03 0.232E-03
DAV: 29 -0.383510051015E+03 -0.68048E-04 -0.31318E-06 219 0.491E-03 0.229E-03
DAV: 30 -0.383510081807E+03 -0.30792E-04 -0.10714E-06 201 0.276E-03 0.120E-03
DAV: 31 -0.383510101816E+03 -0.20009E-04 -0.91833E-07 219 0.237E-03 0.870E-04
DAV: 32 -0.383510116469E+03 -0.14652E-04 -0.45482E-07 201 0.146E-03 0.508E-04
DAV: 33 -0.383510123600E+03 -0.71310E-05 -0.25954E-07 228 0.101E-03
1 F= -.38351012E+03 E0= -.38352673E+03 d E =0.498133E-01