iterations/neb0_image02_iter35_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 0.144874602793E+04 0.14487E+04 -0.44198E+04 330 0.697E+02
DAV: 2 0.224483944662E+03 -0.12243E+04 -0.11471E+04 435 0.163E+02
DAV: 3 -0.363089651948E+03 -0.58757E+03 -0.58443E+03 345 0.114E+02
DAV: 4 -0.433547370028E+03 -0.70458E+02 -0.70231E+02 309 0.509E+01
DAV: 5 -0.435129218500E+03 -0.15818E+01 -0.15792E+01 318 0.781E+00 0.427E+01
DAV: 6 -0.389058211360E+03 0.46071E+02 -0.14836E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385564859697E+03 0.34934E+01 -0.12754E+01 345 0.774E+00 0.104E+01
DAV: 8 -0.384148514200E+03 0.14163E+01 -0.31190E+00 345 0.392E+00 0.442E+00
DAV: 9 -0.383584518210E+03 0.56400E+00 -0.13324E+00 336 0.225E+00 0.119E+00
DAV: 10 -0.383488931242E+03 0.95587E-01 -0.18641E-01 327 0.114E+00 0.896E-01
DAV: 11 -0.383459736627E+03 0.29195E-01 -0.48705E-02 327 0.674E-01 0.782E-01
DAV: 12 -0.383450473128E+03 0.92635E-02 -0.84925E-02 318 0.432E-01 0.610E-01
DAV: 13 -0.383435589244E+03 0.14884E-01 -0.54126E-02 300 0.470E-01 0.757E-01
DAV: 14 -0.383423825688E+03 0.11764E-01 -0.47837E-02 336 0.366E-01 0.333E-01
DAV: 15 -0.383426309397E+03 -0.24837E-02 -0.26478E-02 327 0.309E-01 0.458E-01
DAV: 16 -0.383425561088E+03 0.74831E-03 -0.57684E-03 354 0.256E-01 0.290E-01
DAV: 17 -0.383436944247E+03 -0.11383E-01 -0.51497E-03 291 0.241E-01 0.236E-01
DAV: 18 -0.383446277283E+03 -0.93330E-02 -0.44527E-03 300 0.214E-01 0.230E-01
DAV: 19 -0.383450776055E+03 -0.44988E-02 -0.17066E-03 318 0.119E-01 0.944E-02
DAV: 20 -0.383456996557E+03 -0.62205E-02 -0.39115E-04 300 0.544E-02 0.118E-01
DAV: 21 -0.383466427027E+03 -0.94305E-02 -0.69771E-04 318 0.753E-02 0.590E-02
DAV: 22 -0.383469508023E+03 -0.30810E-02 -0.27588E-04 318 0.424E-02 0.568E-02
DAV: 23 -0.383471416778E+03 -0.19088E-02 -0.81931E-05 327 0.249E-02 0.368E-02
DAV: 24 -0.383474218993E+03 -0.28022E-02 -0.13034E-04 309 0.229E-02 0.210E-02
DAV: 25 -0.383476027520E+03 -0.18085E-02 -0.83326E-05 300 0.178E-02 0.145E-02
DAV: 26 -0.383477060768E+03 -0.10332E-02 -0.56425E-05 282 0.146E-02 0.174E-02
DAV: 27 -0.383477319760E+03 -0.25899E-03 -0.94289E-06 237 0.777E-03 0.155E-02
DAV: 28 -0.383477467162E+03 -0.14740E-03 -0.54068E-06 201 0.620E-03 0.806E-03
DAV: 29 -0.383477569929E+03 -0.10277E-03 -0.39394E-06 228 0.506E-03 0.356E-03
DAV: 30 -0.383477671090E+03 -0.10116E-03 -0.36873E-06 192 0.403E-03 0.202E-03
DAV: 31 -0.383477718303E+03 -0.47213E-04 -0.23274E-06 219 0.343E-03 0.503E-03
DAV: 32 -0.383477729852E+03 -0.11549E-04 -0.76709E-07 228 0.216E-03 0.279E-03
DAV: 33 -0.383477757002E+03 -0.27150E-04 -0.11809E-06 192 0.232E-03 0.182E-03
DAV: 34 -0.383477761663E+03 -0.46615E-05 -0.35443E-07 228 0.156E-03
1 F= -.38347776E+03 E0= -.38349417E+03 d E =0.492182E-01