iterations/neb0_image09_iter11_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 0.145527907718E+04 0.14553E+04 -0.44283E+04 330 0.697E+02
DAV: 2 0.236134329940E+03 -0.12191E+04 -0.11438E+04 417 0.163E+02
DAV: 3 -0.361561734186E+03 -0.59770E+03 -0.59436E+03 354 0.114E+02
DAV: 4 -0.432636523845E+03 -0.71075E+02 -0.70786E+02 318 0.501E+01
DAV: 5 -0.434218029147E+03 -0.15815E+01 -0.15786E+01 318 0.780E+00 0.428E+01
DAV: 6 -0.388192621987E+03 0.46025E+02 -0.14837E+02 309 0.287E+01 0.209E+01
DAV: 7 -0.384713264397E+03 0.34794E+01 -0.13161E+01 345 0.789E+00 0.104E+01
DAV: 8 -0.383269717117E+03 0.14435E+01 -0.24333E+00 345 0.401E+00 0.434E+00
DAV: 9 -0.382731088690E+03 0.53863E+00 -0.11189E+00 327 0.225E+00 0.119E+00
DAV: 10 -0.382646957990E+03 0.84131E-01 -0.13792E-01 345 0.108E+00 0.793E-01
DAV: 11 -0.382623720019E+03 0.23238E-01 -0.98967E-02 345 0.728E-01 0.799E-01
DAV: 12 -0.382607630963E+03 0.16089E-01 -0.81230E-02 345 0.418E-01 0.617E-01
DAV: 13 -0.382605305566E+03 0.23254E-02 -0.19495E-01 372 0.527E-01 0.875E-01
DAV: 14 -0.382582600064E+03 0.22706E-01 -0.69636E-02 318 0.472E-01 0.382E-01
DAV: 15 -0.382582646946E+03 -0.46882E-04 -0.12878E-02 318 0.309E-01 0.243E-01
DAV: 16 -0.382589004153E+03 -0.63572E-02 -0.55693E-03 309 0.254E-01 0.158E-01
DAV: 17 -0.382600648061E+03 -0.11644E-01 -0.47262E-03 300 0.278E-01 0.134E-01
DAV: 18 -0.382609251893E+03 -0.86038E-02 -0.49918E-03 327 0.200E-01 0.199E-01
DAV: 19 -0.382610001928E+03 -0.75004E-03 -0.11529E-03 336 0.798E-02 0.129E-01
DAV: 20 -0.382613090504E+03 -0.30886E-02 -0.50067E-04 300 0.433E-02 0.107E-01
DAV: 21 -0.382620582640E+03 -0.74921E-02 -0.53360E-04 300 0.581E-02 0.477E-02
DAV: 22 -0.382625903914E+03 -0.53213E-02 -0.42389E-04 318 0.487E-02 0.504E-02
DAV: 23 -0.382628648748E+03 -0.27448E-02 -0.17254E-04 327 0.327E-02 0.337E-02
DAV: 24 -0.382630726990E+03 -0.20782E-02 -0.12859E-04 309 0.242E-02 0.204E-02
DAV: 25 -0.382631955672E+03 -0.12287E-02 -0.72290E-05 309 0.180E-02 0.178E-02
DAV: 26 -0.382632695395E+03 -0.73972E-03 -0.37268E-05 291 0.136E-02 0.119E-02
DAV: 27 -0.382633246321E+03 -0.55093E-03 -0.18921E-05 237 0.898E-03 0.529E-03
DAV: 28 -0.382633479550E+03 -0.23323E-03 -0.67961E-06 228 0.518E-03 0.481E-03
DAV: 29 -0.382633693449E+03 -0.21390E-03 -0.95174E-06 219 0.569E-03 0.419E-03
DAV: 30 -0.382633778762E+03 -0.85313E-04 -0.32188E-06 228 0.395E-03 0.145E-03
DAV: 31 -0.382633816211E+03 -0.37449E-04 -0.18745E-06 201 0.273E-03 0.202E-03
DAV: 32 -0.382633836894E+03 -0.20682E-04 -0.75942E-07 228 0.203E-03 0.142E-03
DAV: 33 -0.382633855213E+03 -0.18319E-04 -0.88987E-07 192 0.168E-03 0.645E-04
DAV: 34 -0.382633856824E+03 -0.16103E-05 -0.21647E-07 246 0.928E-04
1 F= -.38263386E+03 E0= -.38265073E+03 d E =0.506137E-01