./iterations/neb0_image01_iter34_OSZICAR.out output for 42: 3.3A-->1.3A 712(amd-3) Si-CH3H...HO-Si two dimer closed (TSS for CH3...OH)
Status:
finished
N E dE d eps ncg rms rms(c)
DAV: 1 0.150938576488E+04 0.15094E+04 -0.43514E+04 322 0.697E+02
DAV: 2 0.252878900512E+03 -0.12565E+04 -0.11788E+04 428 0.164E+02
DAV: 3 -0.355165485582E+03 -0.60804E+03 -0.60419E+03 348 0.118E+02
DAV: 4 -0.433259464400E+03 -0.78094E+02 -0.77770E+02 316 0.534E+01
DAV: 5 -0.435100673590E+03 -0.18412E+01 -0.18382E+01 340 0.827E+00 0.426E+01
DAV: 6 -0.389198596880E+03 0.45902E+02 -0.14912E+02 308 0.286E+01 0.208E+01
DAV: 7 -0.385748424166E+03 0.34502E+01 -0.12602E+01 340 0.776E+00 0.104E+01
DAV: 8 -0.384346241652E+03 0.14022E+01 -0.32542E+00 332 0.387E+00 0.432E+00
DAV: 9 -0.383773698621E+03 0.57254E+00 -0.68615E-01 316 0.202E+00 0.975E-01
DAV: 10 -0.383721106605E+03 0.52592E-01 -0.19284E-01 348 0.937E-01 0.908E-01
DAV: 11 -0.383704830186E+03 0.16276E-01 -0.13432E-01 340 0.439E-01 0.619E-01
DAV: 12 -0.383679173662E+03 0.25657E-01 -0.20195E-02 316 0.402E-01 0.358E-01
DAV: 13 -0.383664312318E+03 0.14861E-01 -0.26938E-02 316 0.462E-01 0.222E-01
DAV: 14 -0.383672241135E+03 -0.79288E-02 -0.18952E-02 300 0.418E-01 0.174E-01
DAV: 15 -0.383679291176E+03 -0.70500E-02 -0.48253E-03 308 0.209E-01 0.113E-01
DAV: 16 -0.383691880955E+03 -0.12590E-01 -0.30084E-03 284 0.160E-01 0.634E-02
DAV: 17 -0.383700576794E+03 -0.86958E-02 -0.17983E-03 324 0.122E-01 0.471E-02
DAV: 18 -0.383708856678E+03 -0.82799E-02 -0.96592E-04 332 0.942E-02 0.373E-02
DAV: 19 -0.383713576445E+03 -0.47198E-02 -0.24615E-04 308 0.458E-02 0.231E-02
DAV: 20 -0.383717736758E+03 -0.41603E-02 -0.23341E-04 316 0.416E-02 0.154E-02
DAV: 21 -0.383721238306E+03 -0.35015E-02 -0.24314E-04 284 0.421E-02 0.101E-02
DAV: 22 -0.383722175708E+03 -0.93740E-03 -0.10743E-04 316 0.287E-02 0.103E-02
DAV: 23 -0.383722516930E+03 -0.34122E-03 -0.79116E-06 228 0.111E-02 0.754E-03
DAV: 24 -0.383723033409E+03 -0.51648E-03 -0.45593E-05 268 0.220E-02 0.566E-03
DAV: 25 -0.383723154696E+03 -0.12129E-03 -0.15932E-05 252 0.128E-02 0.561E-03
DAV: 26 -0.383723208673E+03 -0.53977E-04 -0.93362E-06 244 0.941E-03 0.241E-03
DAV: 27 -0.383723245318E+03 -0.36645E-04 -0.27890E-06 212 0.543E-03 0.228E-03
DAV: 28 -0.383723286975E+03 -0.41656E-04 -0.20829E-06 212 0.482E-03 0.201E-03
DAV: 29 -0.383723306078E+03 -0.19103E-04 -0.19406E-06 228 0.458E-03 0.709E-04
DAV: 30 -0.383723313929E+03 -0.78512E-05 -0.91572E-07 220 0.266E-03
1 F= -.38372331E+03 E0= -.38373180E+03 d E =0.254569E-01