iterations/neb0_image01_iter29_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 0.144718168090E+04 0.14472E+04 -0.44193E+04 330 0.697E+02
DAV: 2 0.224109250486E+03 -0.12231E+04 -0.11459E+04 435 0.163E+02
DAV: 3 -0.363081220129E+03 -0.58719E+03 -0.58375E+03 345 0.114E+02
DAV: 4 -0.433508757289E+03 -0.70428E+02 -0.70153E+02 318 0.508E+01
DAV: 5 -0.435081180652E+03 -0.15724E+01 -0.15699E+01 318 0.779E+00 0.426E+01
DAV: 6 -0.389101663658E+03 0.45980E+02 -0.14807E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385631174065E+03 0.34705E+01 -0.13597E+01 345 0.780E+00 0.104E+01
DAV: 8 -0.384152765809E+03 0.14784E+01 -0.21270E+00 327 0.383E+00 0.433E+00
DAV: 9 -0.383611508673E+03 0.54126E+00 -0.17630E+00 336 0.243E+00 0.137E+00
DAV: 10 -0.383538825574E+03 0.72683E-01 -0.25814E-01 318 0.113E+00 0.103E+00
DAV: 11 -0.383519768354E+03 0.19057E-01 -0.28782E-01 354 0.645E-01 0.993E-01
DAV: 12 -0.383494009421E+03 0.25759E-01 -0.23769E-01 327 0.703E-01 0.935E-01
DAV: 13 -0.383476731747E+03 0.17278E-01 -0.17899E-01 354 0.547E-01 0.664E-01
DAV: 14 -0.383464848493E+03 0.11883E-01 -0.19576E-02 345 0.378E-01 0.323E-01
DAV: 15 -0.383462180358E+03 0.26681E-02 -0.13759E-02 309 0.386E-01 0.190E-01
DAV: 16 -0.383468004682E+03 -0.58243E-02 -0.60263E-03 327 0.244E-01 0.194E-01
DAV: 17 -0.383476176343E+03 -0.81717E-02 -0.28410E-03 291 0.180E-01 0.160E-01
DAV: 18 -0.383482830985E+03 -0.66546E-02 -0.27170E-03 363 0.161E-01 0.124E-01
DAV: 19 -0.383490799920E+03 -0.79689E-02 -0.42941E-03 372 0.161E-01 0.158E-01
DAV: 20 -0.383492694507E+03 -0.18946E-02 -0.14044E-03 318 0.787E-02 0.921E-02
DAV: 21 -0.383497254534E+03 -0.45600E-02 -0.65080E-04 309 0.615E-02 0.992E-02
DAV: 22 -0.383501887155E+03 -0.46326E-02 -0.57016E-04 327 0.537E-02 0.409E-02
DAV: 23 -0.383505993722E+03 -0.41066E-02 -0.24398E-04 318 0.448E-02 0.572E-02
DAV: 24 -0.383509056000E+03 -0.30623E-02 -0.20963E-04 309 0.323E-02 0.290E-02
DAV: 25 -0.383511108839E+03 -0.20528E-02 -0.10453E-04 309 0.216E-02 0.242E-02
DAV: 26 -0.383512305336E+03 -0.11965E-02 -0.68950E-05 309 0.184E-02 0.111E-02
DAV: 27 -0.383513135246E+03 -0.82991E-03 -0.35542E-05 318 0.127E-02 0.129E-02
DAV: 28 -0.383513742535E+03 -0.60729E-03 -0.27979E-05 264 0.998E-03 0.665E-03
DAV: 29 -0.383513961183E+03 -0.21865E-03 -0.98717E-06 237 0.687E-03 0.363E-03
DAV: 30 -0.383514085109E+03 -0.12393E-03 -0.59063E-06 210 0.470E-03 0.326E-03
DAV: 31 -0.383514163070E+03 -0.77961E-04 -0.31377E-06 219 0.315E-03 0.177E-03
DAV: 32 -0.383514196366E+03 -0.33297E-04 -0.15249E-06 219 0.219E-03 0.994E-04
DAV: 33 -0.383514226912E+03 -0.30545E-04 -0.12837E-06 210 0.217E-03 0.796E-04
DAV: 34 -0.383514236358E+03 -0.94465E-05 -0.58408E-07 228 0.137E-03
1 F= -.38351424E+03 E0= -.38353091E+03 d E =0.500118E-01