iterations/neb0_image07_iter50_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 0.144757411480E+04 0.14476E+04 -0.44238E+04 330 0.697E+02
DAV: 2 0.226850623777E+03 -0.12207E+04 -0.11446E+04 426 0.163E+02
DAV: 3 -0.367825482066E+03 -0.59468E+03 -0.59126E+03 363 0.114E+02
DAV: 4 -0.432419512184E+03 -0.64594E+02 -0.64369E+02 309 0.472E+01
DAV: 5 -0.433826224606E+03 -0.14067E+01 -0.14041E+01 336 0.730E+00 0.427E+01
DAV: 6 -0.387939766774E+03 0.45886E+02 -0.15011E+02 309 0.287E+01 0.208E+01
DAV: 7 -0.384501379295E+03 0.34384E+01 -0.12616E+01 336 0.773E+00 0.104E+01
DAV: 8 -0.383088626194E+03 0.14128E+01 -0.33083E+00 327 0.397E+00 0.440E+00
DAV: 9 -0.382500911366E+03 0.58771E+00 -0.65109E-01 327 0.209E+00 0.104E+00
DAV: 10 -0.382441653297E+03 0.59258E-01 -0.40095E-01 345 0.113E+00 0.105E+00
DAV: 11 -0.382414632878E+03 0.27020E-01 -0.59835E-02 318 0.523E-01 0.641E-01
DAV: 12 -0.382395428038E+03 0.19205E-01 -0.36997E-02 327 0.405E-01 0.476E-01
DAV: 13 -0.382376847126E+03 0.18581E-01 -0.61875E-02 318 0.523E-01 0.509E-01
DAV: 14 -0.382371736641E+03 0.51105E-02 -0.28578E-02 336 0.311E-01 0.217E-01
DAV: 15 -0.382375655507E+03 -0.39189E-02 -0.83188E-03 291 0.295E-01 0.226E-01
DAV: 16 -0.382385082703E+03 -0.94272E-02 -0.68627E-03 327 0.258E-01 0.128E-01
DAV: 17 -0.382394801931E+03 -0.97192E-02 -0.43017E-03 291 0.190E-01 0.787E-02
DAV: 18 -0.382403134647E+03 -0.83327E-02 -0.17185E-03 327 0.122E-01 0.770E-02
DAV: 19 -0.382409427358E+03 -0.62927E-02 -0.38713E-04 327 0.530E-02 0.481E-02
DAV: 20 -0.382416621586E+03 -0.71942E-02 -0.53839E-04 309 0.465E-02 0.406E-02
DAV: 21 -0.382420375969E+03 -0.37544E-02 -0.22863E-04 318 0.319E-02 0.238E-02
DAV: 22 -0.382422605944E+03 -0.22300E-02 -0.11332E-04 318 0.262E-02 0.103E-02
DAV: 23 -0.382424021219E+03 -0.14153E-02 -0.48847E-05 282 0.140E-02 0.819E-03
DAV: 24 -0.382424978590E+03 -0.95737E-03 -0.36788E-05 273 0.138E-02 0.429E-03
DAV: 25 -0.382425541282E+03 -0.56269E-03 -0.21037E-05 237 0.984E-03 0.462E-03
DAV: 26 -0.382425775359E+03 -0.23408E-03 -0.67542E-06 228 0.617E-03 0.214E-03
DAV: 27 -0.382425904036E+03 -0.12868E-03 -0.63392E-06 210 0.586E-03 0.275E-03
DAV: 28 -0.382425984608E+03 -0.80572E-04 -0.26193E-06 210 0.453E-03 0.135E-03
DAV: 29 -0.382426006457E+03 -0.21848E-04 -0.26041E-06 228 0.434E-03 0.198E-03
DAV: 30 -0.382426030990E+03 -0.24533E-04 -0.93307E-07 192 0.300E-03 0.874E-04
DAV: 31 -0.382426042703E+03 -0.11713E-04 -0.10453E-06 219 0.228E-03 0.878E-04
DAV: 32 -0.382426048350E+03 -0.56469E-05 -0.22482E-07 219 0.120E-03
1 F= -.38242605E+03 E0= -.38243946E+03 d E =0.402218E-01