iterations/neb0_image06_iter70_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 0.144992442151E+04 0.14499E+04 -0.44245E+04 330 0.697E+02
DAV: 2 0.231020783147E+03 -0.12189E+04 -0.11421E+04 417 0.163E+02
DAV: 3 -0.364096220042E+03 -0.59512E+03 -0.59173E+03 354 0.115E+02
DAV: 4 -0.433198104266E+03 -0.69102E+02 -0.68835E+02 309 0.498E+01
DAV: 5 -0.434748190711E+03 -0.15501E+01 -0.15474E+01 336 0.771E+00 0.428E+01
DAV: 6 -0.388531793571E+03 0.46216E+02 -0.15041E+02 318 0.287E+01 0.209E+01
DAV: 7 -0.385047377275E+03 0.34844E+01 -0.13765E+01 336 0.783E+00 0.104E+01
DAV: 8 -0.383592095346E+03 0.14553E+01 -0.21612E+00 327 0.395E+00 0.443E+00
DAV: 9 -0.383046738595E+03 0.54536E+00 -0.18675E+00 345 0.249E+00 0.141E+00
DAV: 10 -0.382981356803E+03 0.65382E-01 -0.45046E-01 327 0.119E+00 0.864E-01
DAV: 11 -0.382946222781E+03 0.35134E-01 -0.62810E-02 336 0.624E-01 0.643E-01
DAV: 12 -0.382934052702E+03 0.12170E-01 -0.21458E-01 390 0.679E-01 0.941E-01
DAV: 13 -0.382907602694E+03 0.26450E-01 -0.16427E-01 354 0.536E-01 0.378E-01
DAV: 14 -0.382906060224E+03 0.15425E-02 -0.19776E-02 318 0.368E-01 0.429E-01
DAV: 15 -0.382907618022E+03 -0.15578E-02 -0.70671E-03 327 0.279E-01 0.319E-01
DAV: 16 -0.382914644740E+03 -0.70267E-02 -0.17646E-02 336 0.287E-01 0.272E-01
DAV: 17 -0.382925629266E+03 -0.10985E-01 -0.70736E-03 300 0.187E-01 0.835E-02
DAV: 18 -0.382931528286E+03 -0.58990E-02 -0.10686E-03 336 0.907E-02 0.692E-02
DAV: 19 -0.382939458720E+03 -0.79304E-02 -0.73016E-04 345 0.719E-02 0.342E-02
DAV: 20 -0.382946096116E+03 -0.66374E-02 -0.42320E-04 318 0.590E-02 0.479E-02
DAV: 21 -0.382949082741E+03 -0.29866E-02 -0.18300E-04 336 0.356E-02 0.376E-02
DAV: 22 -0.382951766661E+03 -0.26839E-02 -0.13210E-04 300 0.224E-02 0.126E-02
DAV: 23 -0.382954035566E+03 -0.22689E-02 -0.11812E-04 318 0.199E-02 0.113E-02
DAV: 24 -0.382955074845E+03 -0.10393E-02 -0.52940E-05 291 0.145E-02 0.175E-02
DAV: 25 -0.382955486793E+03 -0.41195E-03 -0.13041E-05 237 0.798E-03 0.776E-03
DAV: 26 -0.382955731427E+03 -0.24463E-03 -0.13608E-05 219 0.711E-03 0.346E-03
DAV: 27 -0.382955863334E+03 -0.13191E-03 -0.45556E-06 228 0.538E-03 0.262E-03
DAV: 28 -0.382955915278E+03 -0.51945E-04 -0.17705E-06 228 0.304E-03 0.429E-03
DAV: 29 -0.382955977122E+03 -0.61844E-04 -0.26866E-06 192 0.316E-03 0.156E-03
DAV: 30 -0.382955991945E+03 -0.14823E-04 -0.89216E-07 219 0.229E-03 0.128E-03
DAV: 31 -0.382956003668E+03 -0.11723E-04 -0.67440E-07 228 0.209E-03 0.110E-03
DAV: 32 -0.382956011763E+03 -0.80955E-05 -0.26776E-07 219 0.123E-03
1 F= -.38295601E+03 E0= -.38296842E+03 d E =0.372237E-01