./iterations/neb0_image04_iter32_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 0.151126109929E+04 0.15113E+04 -0.43533E+04 322 0.697E+02
DAV: 2 0.254354941467E+03 -0.12569E+04 -0.11801E+04 428 0.164E+02
DAV: 3 -0.354231080131E+03 -0.60859E+03 -0.60491E+03 348 0.118E+02
DAV: 4 -0.433101808305E+03 -0.78871E+02 -0.78527E+02 316 0.536E+01
DAV: 5 -0.434961410145E+03 -0.18596E+01 -0.18563E+01 340 0.832E+00 0.426E+01
DAV: 6 -0.389165115565E+03 0.45796E+02 -0.14843E+02 308 0.286E+01 0.208E+01
DAV: 7 -0.385706884193E+03 0.34582E+01 -0.12596E+01 340 0.779E+00 0.104E+01
DAV: 8 -0.384280424150E+03 0.14265E+01 -0.18621E+00 332 0.373E+00 0.418E+00
DAV: 9 -0.383739780182E+03 0.54064E+00 -0.81761E-01 332 0.194E+00 0.143E+00
DAV: 10 -0.383698884205E+03 0.40896E-01 -0.69374E-01 348 0.966E-01 0.802E-01
DAV: 11 -0.383666633106E+03 0.32251E-01 -0.42508E-02 324 0.541E-01 0.558E-01
DAV: 12 -0.383644529263E+03 0.22104E-01 -0.38557E-02 324 0.498E-01 0.429E-01
DAV: 13 -0.383629695784E+03 0.14833E-01 -0.25811E-02 316 0.485E-01 0.211E-01
DAV: 14 -0.383629610468E+03 0.85315E-04 -0.98221E-03 308 0.334E-01 0.169E-01
DAV: 15 -0.383638290952E+03 -0.86805E-02 -0.45736E-03 308 0.241E-01 0.124E-01
DAV: 16 -0.383651843084E+03 -0.13552E-01 -0.61815E-03 308 0.257E-01 0.958E-02
DAV: 17 -0.383662545596E+03 -0.10703E-01 -0.37690E-03 324 0.169E-01 0.688E-02
DAV: 18 -0.383666436824E+03 -0.38912E-02 -0.38752E-04 332 0.545E-02 0.584E-02
DAV: 19 -0.383673600941E+03 -0.71641E-02 -0.53533E-04 292 0.718E-02 0.358E-02
DAV: 20 -0.383678033070E+03 -0.44321E-02 -0.40856E-04 332 0.637E-02 0.276E-02
DAV: 21 -0.383680057911E+03 -0.20248E-02 -0.24248E-04 364 0.511E-02 0.191E-02
DAV: 22 -0.383682074162E+03 -0.20163E-02 -0.79835E-05 276 0.429E-02 0.123E-02
DAV: 23 -0.383683531827E+03 -0.14577E-02 -0.14368E-04 316 0.541E-02 0.714E-03
DAV: 24 -0.383684045220E+03 -0.51339E-03 -0.11860E-04 324 0.420E-02 0.655E-03
DAV: 25 -0.383684195785E+03 -0.15057E-03 -0.43223E-05 300 0.219E-02 0.697E-03
DAV: 26 -0.383684265050E+03 -0.69265E-04 -0.50688E-06 220 0.107E-02 0.442E-03
DAV: 27 -0.383684345185E+03 -0.80135E-04 -0.70117E-06 219 0.130E-02 0.259E-03
DAV: 28 -0.383684378493E+03 -0.33308E-04 -0.57744E-06 220 0.680E-03 0.285E-03
DAV: 29 -0.383684387381E+03 -0.88880E-05 -0.13985E-06 236 0.324E-03
1 F= -.38368439E+03 E0= -.38369286E+03 d E =0.254328E-01