iterations/neb0_image08_iter63_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 0.144515334915E+04 0.14452E+04 -0.44182E+04 330 0.697E+02
DAV: 2 0.230698167267E+03 -0.12145E+04 -0.11384E+04 417 0.163E+02
DAV: 3 -0.360968377218E+03 -0.59167E+03 -0.58791E+03 363 0.114E+02
DAV: 4 -0.429440182329E+03 -0.68472E+02 -0.68171E+02 309 0.490E+01
DAV: 5 -0.431004069054E+03 -0.15639E+01 -0.15612E+01 345 0.762E+00 0.423E+01
DAV: 6 -0.385420893666E+03 0.45583E+02 -0.15021E+02 309 0.289E+01 0.207E+01
DAV: 7 -0.382092501697E+03 0.33284E+01 -0.12910E+01 336 0.777E+00 0.103E+01
DAV: 8 -0.380615557329E+03 0.14769E+01 -0.18993E+00 327 0.389E+00 0.435E+00
DAV: 9 -0.380101254382E+03 0.51430E+00 -0.11369E+00 327 0.210E+00 0.124E+00
DAV: 10 -0.380006436748E+03 0.94818E-01 -0.19950E-01 345 0.105E+00 0.943E-01
DAV: 11 -0.379988070057E+03 0.18367E-01 -0.70765E-02 345 0.631E-01 0.805E-01
DAV: 12 -0.379962079490E+03 0.25991E-01 -0.68011E-02 336 0.464E-01 0.633E-01
DAV: 13 -0.379956572668E+03 0.55068E-02 -0.21752E-01 354 0.646E-01 0.540E-01
DAV: 14 -0.379952291552E+03 0.42811E-02 -0.24537E-02 327 0.343E-01 0.541E-01
DAV: 15 -0.379948777887E+03 0.35137E-02 -0.62926E-03 309 0.234E-01 0.562E-01
DAV: 16 -0.379950067917E+03 -0.12900E-02 -0.16358E-02 336 0.352E-01 0.481E-01
DAV: 17 -0.379959391486E+03 -0.93236E-02 -0.99102E-03 354 0.279E-01 0.642E-01
DAV: 18 -0.379958124524E+03 0.12670E-02 -0.21218E-02 354 0.191E-01 0.187E-01
DAV: 19 -0.379966503567E+03 -0.83790E-02 -0.30149E-03 291 0.124E-01 0.389E-01
DAV: 20 -0.379973121836E+03 -0.66183E-02 -0.61131E-03 363 0.181E-01 0.988E-02
DAV: 21 -0.379979091678E+03 -0.59698E-02 -0.15096E-03 318 0.108E-01 0.901E-02
DAV: 22 -0.379983704380E+03 -0.46127E-02 -0.35686E-04 300 0.499E-02 0.862E-02
DAV: 23 -0.379989577544E+03 -0.58732E-02 -0.48817E-04 306 0.629E-02 0.549E-02
DAV: 24 -0.379991646310E+03 -0.20688E-02 -0.17736E-04 327 0.357E-02 0.508E-02
DAV: 25 -0.379992673860E+03 -0.10275E-02 -0.60083E-05 309 0.208E-02 0.223E-02
DAV: 26 -0.379993765291E+03 -0.10914E-02 -0.39942E-05 291 0.146E-02 0.216E-02
DAV: 27 -0.379994824965E+03 -0.10597E-02 -0.48440E-05 291 0.138E-02 0.787E-03
DAV: 28 -0.379995246019E+03 -0.42105E-03 -0.15813E-05 237 0.848E-03 0.671E-03
DAV: 29 -0.379995419874E+03 -0.17385E-03 -0.47581E-06 228 0.541E-03 0.384E-03
DAV: 30 -0.379995565775E+03 -0.14590E-03 -0.79143E-06 219 0.575E-03 0.423E-03
DAV: 31 -0.379995599499E+03 -0.33723E-04 -0.19093E-06 228 0.369E-03 0.339E-03
DAV: 32 -0.379995614438E+03 -0.14940E-04 -0.10236E-06 228 0.250E-03 0.315E-03
DAV: 33 -0.379995625741E+03 -0.11303E-04 -0.45605E-07 219 0.197E-03 0.117E-03
DAV: 34 -0.379995647009E+03 -0.21268E-04 -0.11500E-06 219 0.272E-03 0.259E-03
DAV: 35 -0.379995655477E+03 -0.84678E-05 -0.39379E-07 219 0.211E-03
1 F= -.37999566E+03 E0= -.38001234E+03 d E =0.500558E-01