iterations/neb0_image06_iter72_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 0.144512097881E+04 0.14451E+04 -0.44198E+04 330 0.697E+02
DAV: 2 0.231399513544E+03 -0.12137E+04 -0.11416E+04 426 0.163E+02
DAV: 3 -0.358971977770E+03 -0.59037E+03 -0.58667E+03 354 0.114E+02
DAV: 4 -0.428819514331E+03 -0.69848E+02 -0.69544E+02 309 0.493E+01
DAV: 5 -0.430398098386E+03 -0.15786E+01 -0.15757E+01 327 0.771E+00 0.423E+01
DAV: 6 -0.385077804765E+03 0.45320E+02 -0.14861E+02 309 0.285E+01 0.206E+01
DAV: 7 -0.381703222808E+03 0.33746E+01 -0.12198E+01 327 0.784E+00 0.104E+01
DAV: 8 -0.380276695727E+03 0.14265E+01 -0.19558E+00 327 0.389E+00 0.418E+00
DAV: 9 -0.379715619453E+03 0.56108E+00 -0.55015E-01 336 0.195E+00 0.885E-01
DAV: 10 -0.379658259761E+03 0.57360E-01 -0.10134E-01 345 0.858E-01 0.649E-01
DAV: 11 -0.379625749592E+03 0.32510E-01 -0.21981E-02 318 0.438E-01 0.334E-01
DAV: 12 -0.379606188165E+03 0.19561E-01 -0.15367E-02 318 0.409E-01 0.210E-01
DAV: 13 -0.379605587298E+03 0.60087E-03 -0.19217E-02 327 0.487E-01 0.146E-01
DAV: 14 -0.379617585279E+03 -0.11998E-01 -0.78388E-03 309 0.268E-01 0.127E-01
DAV: 15 -0.379627953062E+03 -0.10368E-01 -0.29301E-03 300 0.150E-01 0.579E-02
DAV: 16 -0.379637511295E+03 -0.95582E-02 -0.18517E-03 309 0.130E-01 0.610E-02
DAV: 17 -0.379645355492E+03 -0.78442E-02 -0.15895E-03 327 0.117E-01 0.483E-02
DAV: 18 -0.379649913428E+03 -0.45579E-02 -0.24683E-04 327 0.419E-02 0.441E-02
DAV: 19 -0.379656815253E+03 -0.69018E-02 -0.54103E-04 300 0.450E-02 0.224E-02
DAV: 20 -0.379659090627E+03 -0.22754E-02 -0.18642E-04 354 0.336E-02 0.110E-02
DAV: 21 -0.379660225675E+03 -0.11350E-02 -0.40285E-05 300 0.161E-02 0.687E-03
DAV: 22 -0.379661021159E+03 -0.79548E-03 -0.27138E-05 246 0.102E-02 0.502E-03
DAV: 23 -0.379661634321E+03 -0.61316E-03 -0.29276E-05 264 0.958E-03 0.298E-03
DAV: 24 -0.379661772321E+03 -0.13800E-03 -0.27921E-06 237 0.410E-03 0.205E-03
DAV: 25 -0.379661894557E+03 -0.12224E-03 -0.42732E-06 201 0.503E-03 0.170E-03
DAV: 26 -0.379661942885E+03 -0.48329E-04 -0.16121E-06 219 0.283E-03 0.149E-03
DAV: 27 -0.379661968074E+03 -0.25189E-04 -0.13247E-06 219 0.293E-03 0.922E-04
DAV: 28 -0.379661979787E+03 -0.11713E-04 -0.58015E-07 219 0.177E-03 0.689E-04
DAV: 29 -0.379661987052E+03 -0.72647E-05 -0.34994E-07 219 0.136E-03
1 F= -.37966199E+03 E0= -.37966585E+03 d E =0.115958E-01