iterations/neb0_image01_iter33_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 0.144720933266E+04 0.14472E+04 -0.44193E+04 330 0.697E+02
DAV: 2 0.224124338766E+03 -0.12231E+04 -0.11460E+04 435 0.163E+02
DAV: 3 -0.363085329364E+03 -0.58721E+03 -0.58377E+03 345 0.114E+02
DAV: 4 -0.433514960313E+03 -0.70430E+02 -0.70154E+02 318 0.508E+01
DAV: 5 -0.435087790638E+03 -0.15728E+01 -0.15703E+01 318 0.779E+00 0.426E+01
DAV: 6 -0.389101702111E+03 0.45986E+02 -0.14809E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385628587364E+03 0.34731E+01 -0.13494E+01 345 0.779E+00 0.104E+01
DAV: 8 -0.384151246519E+03 0.14773E+01 -0.20992E+00 327 0.381E+00 0.432E+00
DAV: 9 -0.383608594653E+03 0.54265E+00 -0.17001E+00 336 0.241E+00 0.138E+00
DAV: 10 -0.383542903402E+03 0.65691E-01 -0.33626E-01 318 0.114E+00 0.105E+00
DAV: 11 -0.383517332911E+03 0.25570E-01 -0.24085E-01 354 0.641E-01 0.990E-01
DAV: 12 -0.383493697545E+03 0.23635E-01 -0.24663E-01 327 0.701E-01 0.888E-01
DAV: 13 -0.383478507432E+03 0.15190E-01 -0.17414E-01 354 0.541E-01 0.728E-01
DAV: 14 -0.383465064607E+03 0.13443E-01 -0.32152E-02 354 0.395E-01 0.389E-01
DAV: 15 -0.383462587290E+03 0.24773E-02 -0.15548E-02 309 0.378E-01 0.272E-01
DAV: 16 -0.383467913488E+03 -0.53262E-02 -0.85390E-03 336 0.261E-01 0.203E-01
DAV: 17 -0.383475033117E+03 -0.71196E-02 -0.27297E-03 291 0.168E-01 0.166E-01
DAV: 18 -0.383482976281E+03 -0.79432E-02 -0.30140E-03 372 0.177E-01 0.137E-01
DAV: 19 -0.383493214146E+03 -0.10238E-01 -0.66036E-03 354 0.196E-01 0.252E-01
DAV: 20 -0.383492203471E+03 0.10107E-02 -0.15375E-03 327 0.927E-02 0.121E-01
DAV: 21 -0.383495787301E+03 -0.35838E-02 -0.58695E-04 300 0.548E-02 0.125E-01
DAV: 22 -0.383501706990E+03 -0.59197E-02 -0.57081E-04 318 0.642E-02 0.622E-02
DAV: 23 -0.383506473563E+03 -0.47666E-02 -0.29041E-04 318 0.437E-02 0.604E-02
DAV: 24 -0.383509645921E+03 -0.31724E-02 -0.14260E-04 309 0.300E-02 0.272E-02
DAV: 25 -0.383511636123E+03 -0.19902E-02 -0.12082E-04 318 0.233E-02 0.183E-02
DAV: 26 -0.383512588506E+03 -0.95238E-03 -0.46461E-05 318 0.164E-02 0.163E-02
DAV: 27 -0.383513260279E+03 -0.67177E-03 -0.20717E-05 264 0.102E-02 0.137E-02
DAV: 28 -0.383513766105E+03 -0.50583E-03 -0.32043E-05 273 0.111E-02 0.521E-03
DAV: 29 -0.383514013124E+03 -0.24702E-03 -0.98394E-06 246 0.791E-03 0.661E-03
DAV: 30 -0.383514100055E+03 -0.86931E-04 -0.32594E-06 228 0.417E-03 0.296E-03
DAV: 31 -0.383514156916E+03 -0.56861E-04 -0.29304E-06 201 0.380E-03 0.354E-03
DAV: 32 -0.383514213115E+03 -0.56199E-04 -0.24320E-06 210 0.337E-03 0.248E-03
DAV: 33 -0.383514228312E+03 -0.15197E-04 -0.85066E-07 228 0.210E-03 0.160E-03
DAV: 34 -0.383514238771E+03 -0.10458E-04 -0.77259E-07 210 0.229E-03 0.116E-03
DAV: 35 -0.383514245198E+03 -0.64269E-05 -0.29444E-07 228 0.116E-03
1 F= -.38351425E+03 E0= -.38353091E+03 d E =0.499806E-01