********************* Core Excitation Data ******************** **************** A.P. Hitchcock & D.C. Mancini **************** * * Formula: c-C8H8 * Name: Cyclooctatetraene * Edge: C 1s * Alpha Formula: C8H8 * Data Source: Hitchcock * Filename: oc-0cckk.os * Ref. Code: HN&86 * Write Date: 93/06/16 * Reference: J. Chem. Phys. 85 (86) 4849. * Source and Purity: N/A * Acquisition Mode: EELS, 2 deg., 2500 eV CRE, 0.7 eV fwhm *-------------------------------------------------------------- * No. of Spectra: 2 name1- 0occ.1 name2- 0occ.os * E (eV) Raw data Osc. Str. per atom (E-2) *-------------------------------------------------------------- 2.796570E+02 1.899000E+03 5.449464E-03 2.798150E+02 1.942000E+03 2.574212E-03 2.799730E+02 1.977000E+03 2.117349E-04 2.801310E+02 1.949000E+03 2.071963E-03 2.802890E+02 1.968000E+03 7.697507E-04 2.804470E+02 1.938000E+03 2.783069E-03 2.806050E+02 1.940000E+03 2.631685E-03 2.807630E+02 1.955000E+03 1.587952E-03 2.809210E+02 2.062000E+03 5.790911E-03 2.810790E+02 2.049000E+03 4.944341E-03 2.812370E+02 1.962000E+03 1.041413E-03 2.813950E+02 2.023000E+03 3.230942E-03 2.815530E+02 1.937000E+03 2.741951E-03 2.817110E+02 1.989000E+03 9.252478E-04 2.818690E+02 2.023000E+03 3.354173E-03 2.820270E+02 2.017000E+03 2.971187E-03 2.821850E+02 2.067000E+03 6.567639E-03 2.823430E+02 2.102000E+03 9.122591E-03 2.825010E+02 2.161000E+03 1.342123E-02 2.826590E+02 2.178000E+03 1.473030E-02 2.828170E+02 2.181000E+03 1.503729E-02 2.829750E+02 2.302000E+03 2.391808E-02 2.831330E+02 2.553000E+03 4.235304E-02 2.832910E+02 2.897000E+03 6.775388E-02 2.834490E+02 3.574000E+03 1.178564E-01 2.836070E+02 4.555000E+03 1.908275E-01 2.837650E+02 6.251000E+03 3.174269E-01 2.839230E+02 8.404000E+03 4.791099E-01 2.840810E+02 1.090400E+04 6.680847E-01 2.842390E+02 1.370900E+04 8.815182E-01 2.843970E+02 1.633800E+04 1.083456E+00 2.845550E+02 1.858600E+04 1.258201E+00 2.847130E+02 1.971400E+04 1.349226E+00 2.848710E+02 2.004600E+04 1.380216E+00 2.850290E+02 1.900600E+04 1.306245E+00 2.851870E+02 1.731800E+04 1.181750E+00 2.853450E+02 1.481300E+04 9.930375E-01 2.855030E+02 1.191600E+04 7.723090E-01 2.856610E+02 9.455000E+03 5.837241E-01 2.858190E+02 7.853000E+03 4.607867E-01 2.859770E+02 6.566000E+03 3.615820E-01 2.861350E+02 6.323000E+03 3.439348E-01 2.862930E+02 6.687000E+03 3.742371E-01 2.864510E+02 7.165000E+03 4.138555E-01 2.866090E+02 7.915000E+03 4.755283E-01 2.867680E+02 8.809000E+03 5.492648E-01 2.869260E+02 9.500000E+03 6.072382E-01 2.870840E+02 9.944000E+03 6.456962E-01 2.872420E+02 1.009700E+04 6.608226E-01 2.874000E+02 1.004500E+04 6.593391E-01 2.875580E+02 9.682000E+03 6.323603E-01 2.877160E+02 9.155000E+03 5.916566E-01 2.878740E+02 8.574000E+03 5.461488E-01 2.880320E+02 8.255000E+03 5.219784E-01 2.881900E+02 8.257000E+03 5.243219E-01 2.883480E+02 7.813000E+03 4.893954E-01 2.885060E+02 7.921000E+03 5.005071E-01 2.886640E+02 7.820000E+03 4.940864E-01 2.888220E+02 7.824000E+03 4.964902E-01 2.889800E+02 8.198000E+03 5.303451E-01 2.891380E+02 8.174000E+03 5.305083E-01 2.892960E+02 8.374000E+03 5.498552E-01 2.894540E+02 8.378000E+03 5.524883E-01 2.896120E+02 8.363000E+03 5.534924E-01 2.897700E+02 8.492000E+03 5.669850E-01 2.899280E+02 8.375000E+03 5.591519E-01 2.900860E+02 8.508000E+03 5.731087E-01 2.902440E+02 8.989000E+03 6.177258E-01 2.904020E+02 9.174000E+03 6.366017E-01 2.905600E+02 9.645000E+03 6.809411E-01 2.907180E+02 1.022600E+04 7.354054E-01 2.908760E+02 1.075300E+04 7.854850E-01 2.910340E+02 1.113900E+04 8.233256E-01 2.911920E+02 1.147700E+04 8.571374E-01 2.913500E+02 1.217500E+04 9.237375E-01 2.915080E+02 1.228900E+04 9.378895E-01 2.916660E+02 1.230400E+04 9.431161E-01 2.918240E+02 1.234100E+04 9.503716E-01 2.919820E+02 1.204600E+04 9.271916E-01 2.921400E+02 1.240000E+04 9.636313E-01 2.922980E+02 1.204200E+04 9.344447E-01 2.924560E+02 1.174300E+04 9.104827E-01 2.926140E+02 1.168800E+04 9.090828E-01 2.927720E+02 1.147800E+04 8.931300E-01 2.929300E+02 1.114300E+04 8.652773E-01 2.930880E+02 1.115600E+04 8.700519E-01 2.932460E+02 1.111800E+04 8.700075E-01 2.934040E+02 1.096800E+04 8.592885E-01 2.935620E+02 1.099500E+04 8.653939E-01 2.937200E+02 1.118300E+04 8.869871E-01 2.938780E+02 1.142700E+04 9.141417E-01 2.940360E+02 1.161800E+04 9.363675E-01 2.941940E+02 1.168000E+04 9.462257E-01 2.943520E+02 1.192100E+04 9.736090E-01 2.945100E+02 1.210900E+04 9.960052E-01 2.946690E+02 1.230800E+04 1.019659E+00 2.948270E+02 1.245500E+04 1.038337E+00 2.949850E+02 1.236000E+04 1.033145E+00 2.951430E+02 1.261100E+04 1.062344E+00 2.953010E+02 1.283700E+04 1.089266E+00 2.954590E+02 1.298400E+04 1.108453E+00 2.956170E+02 1.296100E+04 1.110641E+00 2.957750E+02 1.324100E+04 1.143478E+00 2.959330E+02 1.304700E+04 1.128421E+00 2.960910E+02 1.331000E+04 1.159825E+00 2.962490E+02 1.325600E+04 1.158995E+00 2.964070E+02 1.326100E+04 1.164212E+00 2.965650E+02 1.314200E+04 1.156639E+00 2.967230E+02 1.343500E+04 1.191691E+00 2.968810E+02 1.321000E+04 1.173105E+00 2.970390E+02 1.307000E+04 1.163223E+00 2.971970E+02 1.329200E+04 1.191224E+00 2.973550E+02 1.330200E+04 1.197091E+00 2.975130E+02 1.345600E+04 1.218203E+00 2.976710E+02 1.324900E+04 1.201148E+00 2.978290E+02 1.308600E+04 1.188626E+00 2.979870E+02 1.317900E+04 1.203374E+00 2.981450E+02 1.297100E+04 1.185880E+00 2.983030E+02 1.306100E+04 1.200369E+00 2.984610E+02 1.288700E+04 1.186364E+00 2.986190E+02 1.262900E+04 1.163087E+00 2.987770E+02 1.268200E+04 1.173557E+00 2.989350E+02 1.244400E+04 1.152193E+00 2.990930E+02 1.247500E+04 1.160243E+00 2.992510E+02 1.248000E+04 1.165460E+00 2.994090E+02 1.235300E+04 1.156059E+00 2.995670E+02 1.217900E+04 1.141321E+00 2.997250E+02 1.205400E+04 1.131929E+00 2.998830E+02 1.197100E+04 1.127162E+00 3.000410E+02 1.191000E+04 1.124814E+00 3.001990E+02 1.204500E+04 1.144598E+00 3.003570E+02 1.165500E+04 1.104887E+00 3.005150E+02 1.183900E+04 1.130304E+00 3.006730E+02 1.171800E+04 1.120977E+00 3.008310E+02 1.143200E+04 1.092590E+00 3.009890E+02 1.159100E+04 1.115320E+00 3.011470E+02 1.145600E+04 1.104150E+00 3.013050E+02 1.138800E+04 1.100657E+00 3.014630E+02 1.137700E+04 1.103771E+00 3.016210E+02 1.114400E+04 1.080865E+00 3.017790E+02 1.093300E+04 1.060349E+00 3.019370E+02 1.103300E+04 1.076406E+00 3.020950E+02 1.098300E+04 1.074777E+00 3.022530E+02 1.078600E+04 1.055602E+00 3.024110E+02 1.091900E+04 1.075725E+00 3.025700E+02 1.082500E+04 1.068751E+00 3.027280E+02 1.059200E+04 1.044923E+00 3.028860E+02 1.059600E+04 1.049573E+00 3.030440E+02 1.054800E+04 1.047930E+00 3.032020E+02 1.041700E+04 1.036126E+00 3.033600E+02 1.043800E+04 1.042823E+00 3.035180E+02 1.028700E+04 1.028414E+00 3.036760E+02 1.012500E+04 1.012519E+00 3.038340E+02 1.003500E+04 1.005394E+00 3.039920E+02 1.008000E+04 1.014990E+00 3.041500E+02 9.836000E+03 9.885577E-01 3.043080E+02 9.861000E+03 9.956193E-01 3.044660E+02 9.683000E+03 9.771725E-01 3.046240E+02 9.573000E+03 9.671569E-01 3.047820E+02 9.373000E+03 9.456300E-01 3.049400E+02 9.538000E+03 9.703951E-01 3.050980E+02 9.273000E+03 9.403669E-01 3.052560E+02 9.324000E+03 9.506476E-01 3.054140E+02 9.182000E+03 9.361210E-01 3.055720E+02 9.057000E+03 9.236634E-01 3.057300E+02 9.039000E+03 9.249894E-01 3.058880E+02 8.965000E+03 9.190072E-01 3.060460E+02 9.010000E+03 9.285374E-01 3.062040E+02 8.887000E+03 9.160553E-01 3.063620E+02 8.865000E+03 9.167750E-01 3.065200E+02 8.630000E+03 8.892890E-01 3.066780E+02 8.674000E+03 8.986558E-01 3.068360E+02 8.715000E+03 9.076829E-01 3.069940E+02 8.637000E+03 9.008225E-01 3.071520E+02 8.594000E+03 8.985974E-01 3.073100E+02 8.309000E+03 8.636681E-01 3.074680E+02 8.420000E+03 8.821242E-01 3.076260E+02 8.302000E+03 8.695525E-01 3.077840E+02 8.061000E+03 8.400666E-01 3.079420E+02 8.239000E+03 8.677938E-01 3.081000E+02 8.004000E+03 8.388652E-01 3.082580E+02 7.974000E+03 8.380284E-01 3.084160E+02 8.050000E+03 8.518781E-01 3.085740E+02 7.905000E+03 8.350393E-01 3.087320E+02 7.881000E+03 8.349761E-01 3.088900E+02 7.861000E+03 8.354571E-01 3.090480E+02 7.717000E+03 8.184561E-01 3.092060E+02 7.851000E+03 8.406399E-01 3.093640E+02 7.758000E+03 8.307387E-01 3.095220E+02 7.632000E+03 8.160477E-01 3.096800E+02 7.641000E+03 8.205447E-01 3.098380E+02 7.648000E+03 8.247814E-01 3.099960E+02 7.496000E+03 8.061039E-01 3.101540E+02 7.493000E+03 8.088351E-01 3.103130E+02 7.473000E+03 8.091266E-01 3.104710E+02 7.523000E+03 8.195969E-01 3.106290E+02 7.535000E+03 8.245690E-01 3.107870E+02 7.527000E+03 8.266248E-01 3.109450E+02 7.475000E+03 8.221951E-01 3.111030E+02 7.289000E+03 7.978643E-01 3.112610E+02 7.411000E+03 8.191359E-01 3.114190E+02 7.381000E+03 8.178685E-01 3.115770E+02 7.519000E+03 8.417496E-01 3.117350E+02 7.168000E+03 7.922394E-01 3.118930E+02 7.033000E+03 7.749528E-01 3.120510E+02 7.174000E+03 7.993656E-01 3.122090E+02 7.091000E+03 7.898630E-01 3.123670E+02 7.124000E+03 7.979962E-01 3.125250E+02 7.153000E+03 8.055624E-01 3.126830E+02 7.079000E+03 7.973166E-01 3.128410E+02 7.035000E+03 7.936301E-01 3.129990E+02 6.997000E+03 7.908341E-01 3.131570E+02 6.986000E+03 7.922100E-01 3.133150E+02 6.858000E+03 7.752926E-01 3.134730E+02 6.857000E+03 7.781636E-01 3.136310E+02 6.924000E+03 7.917539E-01 3.137890E+02 6.827000E+03 7.795033E-01 3.139470E+02 6.655000E+03 7.552373E-01 3.141050E+02 6.920000E+03 8.004082E-01 3.142630E+02 6.703000E+03 7.688189E-01 3.144210E+02 6.682000E+03 7.684408E-01 3.145790E+02 6.694000E+03 7.733669E-01 3.147370E+02 6.821000E+03 7.969204E-01 3.148950E+02 6.733000E+03 7.857314E-01 3.150530E+02 6.831000E+03 8.047625E-01 3.152110E+02 6.671000E+03 7.817035E-01 3.153690E+02 6.741000E+03 7.962433E-01 3.155270E+02 6.612000E+03 7.780605E-01 3.156850E+02 6.593000E+03 7.779365E-01 3.158430E+02 6.546000E+03 7.731487E-01 3.160010E+02 6.518000E+03 7.714799E-01 3.161590E+02 6.384000E+03 7.520406E-01 3.163170E+02 6.707000E+03 8.092330E-01 3.164750E+02 6.460000E+03 7.707026E-01 3.166330E+02 6.670000E+03 8.092496E-01 3.167910E+02 6.412000E+03 7.685291E-01 3.169490E+02 6.434000E+03 7.752601E-01 3.171070E+02 6.448000E+03 7.806573E-01 3.172650E+02 6.541000E+03 7.996649E-01 3.174230E+02 6.444000E+03 7.860279E-01 3.175810E+02 6.331000E+03 7.694843E-01 3.177390E+02 6.425000E+03 7.888039E-01 3.178970E+02 6.264000E+03 7.637525E-01 3.180550E+02 6.406000E+03 7.915812E-01 3.182140E+02 6.217000E+03 7.614120E-01 3.183720E+02 6.252000E+03 7.705310E-01 3.185300E+02 6.157000E+03 7.566762E-01 3.186880E+02 6.171000E+03 7.620834E-01 3.188460E+02 6.194000E+03 7.691311E-01 3.190040E+02 6.110000E+03 7.570390E-01 3.191620E+02 6.040000E+03 7.473705E-01 3.193200E+02 6.137000E+03 7.677659E-01 3.194780E+02 6.125000E+03 7.685462E-01 3.196360E+02 6.012000E+03 7.509474E-01 3.197940E+02 6.124000E+03 7.742860E-01 3.199520E+02 6.029000E+03 7.598569E-01 3.201100E+02 5.961000E+03 7.502704E-01 3.202680E+02 5.913000E+03 7.442961E-01 3.204260E+02 6.095000E+03 7.808867E-01 3.205840E+02 5.908000E+03 7.490960E-01 3.207420E+02 5.907000E+03 7.517892E-01 3.209000E+02 5.814000E+03 7.372448E-01 3.210580E+02 5.758000E+03 7.295377E-01 3.212160E+02 5.758000E+03 7.323447E-01 3.213740E+02 5.871000E+03 7.565697E-01 3.215320E+02 5.732000E+03 7.330284E-01 3.216900E+02 5.676000E+03 7.251449E-01 3.218480E+02 5.930000E+03 7.766139E-01 3.220060E+02 5.700000E+03 7.353374E-01 3.221640E+02 5.829000E+03 7.630668E-01 3.223220E+02 5.779000E+03 7.562925E-01 3.224800E+02 5.606000E+03 7.255324E-01 3.226380E+02 5.633000E+03 7.335795E-01 3.227960E+02 5.751000E+03 7.595147E-01 3.229540E+02 5.530000E+03 7.189412E-01 3.231120E+02 5.635000E+03 7.424239E-01 3.232700E+02 5.489000E+03 7.163222E-01 3.234280E+02 5.629000E+03 7.469218E-01 3.235860E+02 5.538000E+03 7.315999E-01 3.237440E+02 5.690000E+03 7.648588E-01