iterations/neb0_image03_iter111_EIGENVAL output for 44: 750-->752: Si-OH + Si-H , to Si-O-SI + H2 (TSS)
Status: finished18 18 1 1 0.5555556E+02 0.1000000E-08 0.1000000E-08 0.1000000E-08 0.5000000E-15 1.000000000000000E-004 CAR No title 50 8 35 0.0000000E+00 0.0000000E+00 0.0000000E+00 0.1250000E+00 1 -24.278794900 1.000000 2 -23.972238094 1.000000 3 -23.620140670 1.000000 4 -23.300806382 1.000000 5 -14.044449237 1.000000 6 -13.366199968 1.000000 7 -12.507592556 1.000000 8 -11.460541238 1.000000 9 -10.443577547 1.000000 10 -9.992866188 1.000000 11 -9.405669413 1.000000 12 -9.303453678 1.000000 13 -8.882955757 1.000000 14 -8.713385269 1.000000 15 -8.345878657 1.000000 16 -8.141299388 1.000000 17 -7.832126979 1.000000 18 -7.298254154 1.000000 19 -7.256882492 1.000000 20 -7.076256788 1.000000 21 -6.766314571 1.000000 22 -6.293612212 1.000131 23 -6.268273472 1.000256 24 -5.978098506 1.033071 25 -5.846816541 0.961762 26 -0.029343877 0.000000 27 0.227355067 0.000000 28 0.426026818 0.000000 29 0.638686906 0.000000 30 0.889095104 0.000000 31 1.238886699 0.000000 32 1.387127681 0.000000 33 1.464153137 0.000000 34 1.613166328 0.000000 35 1.722441671 0.000000 0.5000000E+00 0.0000000E+00 0.0000000E+00 0.1250000E+00 1 -24.279226252 1.000000 2 -23.972851426 1.000000 3 -23.620496852 1.000000 4 -23.301386852 1.000000 5 -14.044678958 1.000000 6 -13.366555621 1.000000 7 -12.507993563 1.000000 8 -11.461157163 1.000000 9 -10.442443110 1.000000 10 -9.993806882 1.000000 11 -9.407769391 1.000000 12 -9.303681815 1.000000 13 -8.882273086 1.000000 14 -8.713477555 1.000000 15 -8.346342537 1.000000 16 -8.141818347 1.000000 17 -7.832868989 1.000000 18 -7.299171792 1.000000 19 -7.257874884 1.000000 20 -7.078567405 1.000000 21 -6.767312247 1.000000 22 -6.293319159 1.000132 23 -6.269293711 1.000249 24 -5.973871396 1.033696 25 -5.853324971 0.972441 26 0.109387556 0.000000 27 0.248637367 0.000000 28 0.450210825 0.000000 29 0.638494951 0.000000 30 0.790078140 0.000000 31 0.992549404 0.000000 32 1.356193951 0.000000 33 1.388110925 0.000000 34 1.652582781 0.000000 35 1.801789813 0.000000 0.0000000E+00 0.5000000E+00 0.0000000E+00 0.1250000E+00 1 -24.279288556 1.000000 2 -23.972722708 1.000000 3 -23.620636352 1.000000 4 -23.301355457 1.000000 5 -14.043913330 1.000000 6 -13.366301029 1.000000 7 -12.510233510 1.000000 8 -11.461558618 1.000000 9 -10.438985988 1.000000 10 -9.993435158 1.000000 11 -9.405805378 1.000000 12 -9.310904200 1.000000 13 -8.882415165 1.000000 14 -8.712723660 1.000000 15 -8.346968945 1.000000 16 -8.143162081 1.000000 17 -7.833629281 1.000000 18 -7.293110718 1.000000 19 -7.257912736 1.000000 20 -7.077461418 1.000000 21 -6.765223312 1.000000 22 -6.295311520 1.000125 23 -6.269399206 1.000249 24 -5.977910542 1.033100 25 -5.845136648 0.958840 26 -0.009233958 0.000000 27 0.248624287 0.000000 28 0.409475475 0.000000 29 0.645174412 0.000000 30 0.969927394 0.000000 31 1.027074535 0.000000 32 1.167553073 0.000000 33 1.571128118 0.000000 34 1.648001658 0.000000 35 1.680384898 0.000000 0.0000000E+00 0.0000000E+00 0.5000000E+00 0.1250000E+00 1 -24.279343015 1.000000 2 -23.972748441 1.000000 3 -23.620600572 1.000000 4 -23.301313743 1.000000 5 -14.044702943 1.000000 6 -13.366364482 1.000000 7 -12.507978654 1.000000 8 -11.461334857 1.000000 9 -10.443225847 1.000000 10 -9.993654408 1.000000 11 -9.406773855 1.000000 12 -9.303411735 1.000000 13 -8.883112109 1.000000 14 -8.714224661 1.000000 15 -8.345346838 1.000000 16 -8.142239384 1.000000 17 -7.833649161 1.000000 18 -7.299172191 1.000000 19 -7.257492647 1.000000 20 -7.077244369 1.000000 21 -6.765875721 1.000000 22 -6.294091353 1.000129 23 -6.269138543 1.000250 24 -5.978909132 1.032943 25 -5.848661470 0.964892 26 0.061301608 0.000000 27 0.237640572 0.000000 28 0.461785977 0.000000 29 0.635935670 0.000000 30 0.747523413 0.000000 31 1.182208793 0.000000 32 1.330055868 0.000000 33 1.494857695 0.000000 34 1.572906773 0.000000 35 1.701565370 0.000000 0.5000000E+00 0.5000000E+00 0.0000000E+00 0.1250000E+00 1 -24.279251167 1.000000 2 -23.972897793 1.000000 3 -23.620566500 1.000000 4 -23.301204794 1.000000 5 -14.043958304 1.000000 6 -13.366266406 1.000000 7 -12.510235541 1.000000 8 -11.461591341 1.000000 9 -10.437633486 1.000000 10 -9.993913646 1.000000 11 -9.407490207 1.000000 12 -9.310613199 1.000000 13 -8.881347725 1.000000 14 -8.712301156 1.000000 15 -8.346843868 1.000000 16 -8.143250493 1.000000 17 -7.833800175 1.000000 18 -7.292828905 1.000000 19 -7.257943220 1.000000 20 -7.079025563 1.000000 21 -6.765438917 1.000000 22 -6.294907899 1.000126 23 -6.269497417 1.000248 24 -5.973178680 1.033792 25 -5.850836219 0.968477 26 0.079699490 0.000000 27 0.304981039 0.000000 28 0.488145047 0.000000 29 0.577771405 0.000000 30 0.818992928 0.000000 31 1.100586601 0.000000 32 1.213673634 0.000000 33 1.365600079 0.000000 34 1.467484186 0.000000 35 1.649048555 0.000000 0.0000000E+00 0.5000000E+00 0.5000000E+00 0.1250000E+00 1 -24.279088351 1.000000 2 -23.972766003 1.000000 3 -23.620621763 1.000000 4 -23.301387193 1.000000 5 -14.043976489 1.000000 6 -13.366188270 1.000000 7 -12.510350022 1.000000 8 -11.461499532 1.000000 9 -10.438386590 1.000000 10 -9.993716237 1.000000 11 -9.406381359 1.000000 12 -9.310590251 1.000000 13 -8.882038657 1.000000 14 -8.713151245 1.000000 15 -8.345807112 1.000000 16 -8.143713701 1.000000 17 -7.834433890 1.000000 18 -7.292928838 1.000000 19 -7.257740113 1.000000 20 -7.077779215 1.000000 21 -6.764099648 1.000000 22 -6.295393651 1.000124 23 -6.269863182 1.000246 24 -5.977925210 1.033098 25 -5.845932026 0.960232 26 0.044153447 0.000000 27 0.262401419 0.000000 28 0.425588103 0.000000 29 0.675708351 0.000000 30 0.877162292 0.000000 31 1.062349435 0.000000 32 1.275271283 0.000000 33 1.421393202 0.000000 34 1.533750473 0.000000 35 1.652642569 0.000000 0.5000000E+00 0.0000000E+00 0.5000000E+00 0.1250000E+00 1 -24.279226488 1.000000 2 -23.972773207 1.000000 3 -23.620424152 1.000000 4 -23.301452578 1.000000 5 -14.044733553 1.000000 6 -13.366465407 1.000000 7 -12.508018928 1.000000 8 -11.461237050 1.000000 9 -10.441862693 1.000000 10 -9.994019308 1.000000 11 -9.408231652 1.000000 12 -9.303342097 1.000000 13 -8.881906227 1.000000 14 -8.713713305 1.000000 15 -8.345280205 1.000000 16 -8.142479259 1.000000 17 -7.833811674 1.000000 18 -7.298907031 1.000000 19 -7.257963376 1.000000 20 -7.078769909 1.000000 21 -6.766252240 1.000000 22 -6.293207282 1.000132 23 -6.269181921 1.000250 24 -5.973850360 1.033699 25 -5.854334880 0.974008 26 0.147738996 0.000000 27 0.251243213 0.000000 28 0.546515359 0.000000 29 0.655471551 0.000000 30 0.839753422 0.000000 31 0.981071864 0.000000 32 1.234729516 0.000000 33 1.362754276 0.000000 34 1.553012734 0.000000 35 1.733616256 0.000000 0.5000000E+00 0.5000000E+00 0.5000000E+00 0.1250000E+00 1 -24.278799281 1.000000 2 -23.972325793 1.000000 3 -23.620175742 1.000000 4 -23.300983553 1.000000 5 -14.043823370 1.000000 6 -13.365975792 1.000000 7 -12.510097929 1.000000 8 -11.461085415 1.000000 9 -10.436838248 1.000000 10 -9.993911698 1.000000 11 -9.407680691 1.000000 12 -9.310041844 1.000000 13 -8.880502238 1.000000 14 -8.712341399 1.000000 15 -8.345332038 1.000000 16 -8.143571505 1.000000 17 -7.834255065 1.000000 18 -7.292143188 1.000000 19 -7.257335115 1.000000 20 -7.078446817 1.000000 21 -6.763914336 1.000000 22 -6.294276091 1.000128 23 -6.269270606 1.000250 24 -5.972647875 1.033863 25 -5.851198148 0.969063 26 0.120644032 0.000000 27 0.294747955 0.000000 28 0.497737097 0.000000 29 0.594135524 0.000000 30 0.929517707 0.000000 31 1.137659288 0.000000 32 1.225121296 0.000000 33 1.376036758 0.000000 34 1.410449399 0.000000 35 1.724451872 0.000000