iterations/neb0_image01_iter34_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 0.144722353611E+04 0.14472E+04 -0.44193E+04 330 0.697E+02
DAV: 2 0.224125116489E+03 -0.12231E+04 -0.11460E+04 435 0.163E+02
DAV: 3 -0.363086637288E+03 -0.58721E+03 -0.58377E+03 345 0.114E+02
DAV: 4 -0.433517600979E+03 -0.70431E+02 -0.70155E+02 318 0.508E+01
DAV: 5 -0.435090677956E+03 -0.15731E+01 -0.15706E+01 318 0.779E+00 0.426E+01
DAV: 6 -0.389101897890E+03 0.45989E+02 -0.14810E+02 309 0.285E+01 0.208E+01
DAV: 7 -0.385627481676E+03 0.34744E+01 -0.13442E+01 345 0.779E+00 0.104E+01
DAV: 8 -0.384150907793E+03 0.14766E+01 -0.20971E+00 327 0.381E+00 0.432E+00
DAV: 9 -0.383607258919E+03 0.54365E+00 -0.16574E+00 336 0.240E+00 0.136E+00
DAV: 10 -0.383542814419E+03 0.64444E-01 -0.34269E-01 318 0.114E+00 0.105E+00
DAV: 11 -0.383516474438E+03 0.26340E-01 -0.23000E-01 354 0.637E-01 0.985E-01
DAV: 12 -0.383494531773E+03 0.21943E-01 -0.25160E-01 327 0.703E-01 0.898E-01
DAV: 13 -0.383478986442E+03 0.15545E-01 -0.17813E-01 354 0.543E-01 0.735E-01
DAV: 14 -0.383465195857E+03 0.13791E-01 -0.40959E-02 354 0.397E-01 0.405E-01
DAV: 15 -0.383462672093E+03 0.25238E-02 -0.17458E-02 309 0.384E-01 0.297E-01
DAV: 16 -0.383467580940E+03 -0.49088E-02 -0.97357E-03 327 0.260E-01 0.201E-01
DAV: 17 -0.383474488886E+03 -0.69079E-02 -0.27295E-03 291 0.166E-01 0.166E-01
DAV: 18 -0.383482499924E+03 -0.80110E-02 -0.30832E-03 372 0.179E-01 0.133E-01
DAV: 19 -0.383493156470E+03 -0.10657E-01 -0.70485E-03 354 0.201E-01 0.273E-01
DAV: 20 -0.383491842789E+03 0.13137E-02 -0.16198E-03 327 0.940E-02 0.132E-01
DAV: 21 -0.383494986401E+03 -0.31436E-02 -0.57143E-04 300 0.537E-02 0.128E-01
DAV: 22 -0.383501120337E+03 -0.61339E-02 -0.57331E-04 318 0.656E-02 0.644E-02
DAV: 23 -0.383506538373E+03 -0.54180E-02 -0.36860E-04 318 0.482E-02 0.687E-02
DAV: 24 -0.383509649080E+03 -0.31107E-02 -0.14730E-04 309 0.324E-02 0.340E-02
DAV: 25 -0.383511577929E+03 -0.19288E-02 -0.12637E-04 318 0.245E-02 0.227E-02
DAV: 26 -0.383512598730E+03 -0.10208E-02 -0.54940E-05 318 0.193E-02 0.162E-02
DAV: 27 -0.383513268206E+03 -0.66948E-03 -0.22788E-05 282 0.104E-02 0.147E-02
DAV: 28 -0.383513747830E+03 -0.47962E-03 -0.26247E-05 255 0.991E-03 0.517E-03
DAV: 29 -0.383514013214E+03 -0.26538E-03 -0.14113E-05 255 0.874E-03 0.828E-03
DAV: 30 -0.383514128576E+03 -0.11536E-03 -0.39115E-06 210 0.505E-03 0.389E-03
DAV: 31 -0.383514184982E+03 -0.56406E-04 -0.44791E-06 228 0.408E-03 0.437E-03
DAV: 32 -0.383514234100E+03 -0.49118E-04 -0.19065E-06 210 0.323E-03 0.257E-03
DAV: 33 -0.383514259696E+03 -0.25596E-04 -0.89647E-07 219 0.188E-03 0.171E-03
DAV: 34 -0.383514271356E+03 -0.11660E-04 -0.41697E-07 219 0.162E-03 0.944E-04
DAV: 35 -0.383514282705E+03 -0.11349E-04 -0.53947E-07 192 0.171E-03 0.119E-03
DAV: 36 -0.383514284631E+03 -0.19257E-05 -0.14537E-07 237 0.902E-04
1 F= -.38351428E+03 E0= -.38353094E+03 d E =0.499710E-01