iterations/neb0_image09_iter4_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 0.145269402511E+04 0.14527E+04 -0.44274E+04 330 0.697E+02
DAV: 2 0.236643641934E+03 -0.12161E+04 -0.11426E+04 417 0.163E+02
DAV: 3 -0.360147924386E+03 -0.59679E+03 -0.59284E+03 363 0.114E+02
DAV: 4 -0.431484744736E+03 -0.71337E+02 -0.71036E+02 318 0.496E+01
DAV: 5 -0.433054804579E+03 -0.15701E+01 -0.15673E+01 318 0.769E+00 0.427E+01
DAV: 6 -0.387499470446E+03 0.45555E+02 -0.14708E+02 309 0.287E+01 0.208E+01
DAV: 7 -0.384045299179E+03 0.34542E+01 -0.12877E+01 345 0.784E+00 0.104E+01
DAV: 8 -0.382643567464E+03 0.14017E+01 -0.32983E+00 336 0.410E+00 0.439E+00
DAV: 9 -0.382100544505E+03 0.54302E+00 -0.10896E+00 327 0.235E+00 0.134E+00
DAV: 10 -0.382007568758E+03 0.92976E-01 -0.23415E-01 336 0.127E+00 0.861E-01
DAV: 11 -0.381979195341E+03 0.28373E-01 -0.42979E-02 318 0.602E-01 0.669E-01
DAV: 12 -0.381961777825E+03 0.17418E-01 -0.38196E-02 363 0.500E-01 0.606E-01
DAV: 13 -0.381942418321E+03 0.19360E-01 -0.28328E-02 318 0.460E-01 0.287E-01
DAV: 14 -0.381944870377E+03 -0.24521E-02 -0.14363E-02 327 0.389E-01 0.401E-01
DAV: 15 -0.381944812640E+03 0.57737E-04 -0.84475E-03 336 0.317E-01 0.259E-01
DAV: 16 -0.381949828213E+03 -0.50156E-02 -0.65082E-03 327 0.193E-01 0.193E-01
DAV: 17 -0.381958649248E+03 -0.88210E-02 -0.28127E-03 291 0.160E-01 0.191E-01
DAV: 18 -0.381966600168E+03 -0.79509E-02 -0.27432E-03 309 0.149E-01 0.910E-02
DAV: 19 -0.381973128804E+03 -0.65286E-02 -0.12140E-03 318 0.113E-01 0.547E-02
DAV: 20 -0.381978972091E+03 -0.58433E-02 -0.44294E-04 318 0.552E-02 0.433E-02
DAV: 21 -0.381986612343E+03 -0.76403E-02 -0.52710E-04 291 0.462E-02 0.229E-02
DAV: 22 -0.381989156280E+03 -0.25439E-02 -0.13602E-04 327 0.253E-02 0.200E-02
DAV: 23 -0.381991132066E+03 -0.19758E-02 -0.73330E-05 282 0.175E-02 0.114E-02
DAV: 24 -0.381992506856E+03 -0.13748E-02 -0.58753E-05 291 0.133E-02 0.673E-03
DAV: 25 -0.381993376749E+03 -0.86989E-03 -0.40368E-05 264 0.116E-02 0.526E-03
DAV: 26 -0.381993592569E+03 -0.21582E-03 -0.38887E-06 228 0.456E-03 0.342E-03
DAV: 27 -0.381993815039E+03 -0.22247E-03 -0.78973E-06 201 0.584E-03 0.208E-03
DAV: 28 -0.381993867461E+03 -0.52422E-04 -0.21060E-06 237 0.301E-03 0.150E-03
DAV: 29 -0.381993910576E+03 -0.43115E-04 -0.13468E-06 192 0.269E-03 0.115E-03
DAV: 30 -0.381993955192E+03 -0.44616E-04 -0.20339E-06 210 0.264E-03 0.140E-03
DAV: 31 -0.381993962700E+03 -0.75085E-05 -0.50611E-07 237 0.190E-03
1 F= -.38199396E+03 E0= -.38201117E+03 d E =0.516120E-01