********************* Core Excitation Data ******************** **************** A.P. Hitchcock & D.C. Mancini **************** * * Formula: NO2C6H5 * Name: nitro benzene * Edge: N 1s * Alpha Formula: C6H5NO2 * Data Source: Hitchcock * Filename: nj-0nnkk.os * Ref. Code: TUH96 * Write Date: 08/05/98 * Reference: Can. J. Chem. 74 (1996) 851. * Source and Purity: scavenged from chem fume hood * Acquisition Mode: EELS, 2 deg, 2500eV CRE mode, 0.7eV fwhm *-------------------------------------------------------------- * No. of Spectra: 2 name1- 0njn-n name2- 0njn.os * E (eV) Raw data Osc. Str. per atom (E-2) *-------------------------------------------------------------- 3.909626E+02 1.995196E+04 6.753821E-03 3.911612E+02 2.001745E+04 3.939060E-02 3.913598E+02 1.987297E+04 7.035243E-03 3.915584E+02 1.976730E+04 -1.341224E-02 3.917569E+02 1.960575E+04 -5.136060E-02 3.919555E+02 1.979119E+04 1.850301E-02 3.921541E+02 1.977670E+04 2.616105E-02 3.923527E+02 1.961505E+04 -1.211281E-02 3.925512E+02 1.962085E+04 1.841125E-03 3.927498E+02 1.969841E+04 3.809823E-02 3.929484E+02 1.938611E+04 -4.771027E-02 3.931469E+02 1.956442E+04 2.020231E-02 3.933455E+02 1.945820E+04 -1.224573E-03 3.935441E+02 1.920130E+04 -7.021876E-02 3.937426E+02 1.949178E+04 3.312746E-02 3.939412E+02 1.953425E+04 5.846014E-02 3.941398E+02 1.928521E+04 -8.426902E-03 3.943384E+02 1.916397E+04 -3.509458E-02 3.945369E+02 1.912289E+04 -3.641460E-02 3.947355E+02 1.912299E+04 -2.474138E-02 3.949341E+02 1.912351E+04 -1.297875E-02 3.951327E+02 1.918231E+04 1.749451E-02 3.953312E+02 1.915019E+04 1.882473E-02 3.955298E+02 1.924900E+04 6.204402E-02 3.957284E+02 1.909264E+04 2.361851E-02 3.959766E+02 1.889659E+04 -2.485395E-02 3.961751E+02 1.885869E+04 -2.560045E-02 3.963737E+02 1.874928E+04 -4.941083E-02 3.965723E+02 1.877833E+04 -2.861143E-02 3.967709E+02 1.876418E+04 -2.185937E-02 3.969694E+02 1.883888E+04 1.367659E-02 3.971680E+02 1.878238E+04 6.734923E-03 3.973666E+02 1.866961E+04 -6.909991E-04 3.975652E+02 1.858342E+04 -2.242743E-02 3.977637E+02 1.858850E+04 1.795513E-03 3.979623E+02 1.865654E+04 6.060877E-03 3.981609E+02 1.859888E+04 1.498337E-02 3.983594E+02 1.861268E+04 3.260517E-02 3.985580E+02 1.850218E+04 -4.944787E-03 3.987566E+02 1.862654E+04 2.965106E-02 3.989551E+02 1.856386E+04 2.824160E-02 3.991537E+02 1.846808E+04 -2.984663E-03 3.993523E+02 1.827576E+04 -9.548895E-03 3.995509E+02 1.818445E+04 -1.520557E-02 3.997495E+02 1.838255E+04 1.755764E-02 3.999480E+02 1.823822E+04 1.176194E-03 4.001466E+02 1.831972E+04 9.725422E-04 4.003452E+02 1.807733E+04 -1.166350E-02 4.005437E+02 1.813900E+04 -7.208673E-03 4.007423E+02 1.811583E+04 -6.328701E-03 4.008698E+02 1.803130E+04 -1.278626E-02 4.009691E+02 1.817594E+04 2.604597E-02 4.010684E+02 1.810163E+04 5.835137E-02 4.011677E+02 1.806609E+04 6.913367E-02 4.012670E+02 1.812035E+04 3.390060E-02 4.013663E+02 1.815790E+04 6.994567E-02 4.014656E+02 1.802701E+04 2.634914E-02 4.015648E+02 1.800014E+04 3.803148E-02 4.016641E+02 1.814029E+04 3.035126E-02 4.017634E+02 1.801114E+04 1.376338E-02 4.018627E+02 1.800199E+04 4.485620E-02 4.019620E+02 1.811479E+04 4.270300E-02 4.020613E+02 1.800926E+04 4.302405E-02 4.021606E+02 1.801858E+04 4.950158E-02 4.022599E+02 1.805650E+04 4.909288E-02 4.023591E+02 1.816370E+04 8.965150E-02 4.024584E+02 1.802617E+04 7.179001E-02 4.025577E+02 1.810944E+04 1.013970E-01 4.026570E+02 1.844643E+04 1.757545E-01 4.027563E+02 1.877714E+04 2.483947E-01 4.028556E+02 1.902514E+04 3.490433E-01 4.029549E+02 1.986764E+04 6.154341E-01 4.030541E+02 2.110747E+04 9.899499E-01 4.031534E+02 2.254083E+04 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4.083659E+02 1.917796E+04 7.991380E-01 4.084652E+02 1.920136E+04 7.221298E-01 4.085645E+02 1.897656E+04 6.627150E-01 4.086638E+02 1.873882E+04 6.044719E-01 4.087631E+02 1.870087E+04 6.368276E-01 4.088623E+02 1.874015E+04 6.375856E-01 4.089616E+02 1.863587E+04 6.519546E-01 4.090609E+02 1.881751E+04 7.014407E-01 4.091602E+02 1.896779E+04 7.640662E-01 4.092595E+02 1.920429E+04 8.825546E-01 4.093588E+02 1.945914E+04 9.368553E-01 4.094581E+02 1.954713E+04 9.471830E-01 4.095573E+02 1.952646E+04 9.470211E-01 4.096566E+02 1.933234E+04 8.867468E-01 4.097559E+02 1.932221E+04 8.768723E-01 4.098552E+02 1.921401E+04 8.713897E-01 4.099545E+02 1.902148E+04 8.100419E-01 4.100538E+02 1.902311E+04 8.427326E-01 4.101531E+02 1.918097E+04 8.814907E-01 4.102523E+02 1.949196E+04 9.911324E-01 4.103516E+02 1.970857E+04 1.066433E+00 4.104509E+02 2.004889E+04 1.171633E+00 4.105502E+02 2.017879E+04 1.235590E+00 4.106495E+02 2.023747E+04 1.260220E+00 4.107488E+02 2.032721E+04 1.317847E+00 4.108481E+02 2.044500E+04 1.371775E+00 4.109474E+02 2.067530E+04 1.422256E+00 4.110466E+02 2.096148E+04 1.502070E+00 4.111459E+02 2.083503E+04 1.491062E+00 4.112452E+02 2.090087E+04 1.523145E+00 4.113445E+02 2.114198E+04 1.614215E+00 4.114438E+02 2.125450E+04 1.676705E+00 4.115431E+02 2.143866E+04 1.766932E+00 4.116424E+02 2.170515E+04 1.829313E+00 4.117416E+02 2.193903E+04 1.899453E+00 4.119295E+02 2.209412E+04 1.983852E+00 4.121281E+02 2.239277E+04 2.078133E+00 4.123763E+02 2.250400E+04 2.121112E+00 4.125749E+02 2.247782E+04 2.203495E+00 4.127734E+02 2.252464E+04 2.213436E+00 4.129720E+02 2.261245E+04 2.216901E+00 4.131706E+02 2.260809E+04 2.259185E+00 4.133691E+02 2.257839E+04 2.209712E+00 4.135677E+02 2.252759E+04 2.230730E+00 4.137663E+02 2.214579E+04 2.157595E+00 4.139649E+02 2.180713E+04 2.057838E+00 4.141634E+02 2.180181E+04 2.030932E+00 4.143620E+02 2.151130E+04 1.993346E+00 4.145606E+02 2.108588E+04 1.848685E+00 4.147592E+02 2.087938E+04 1.784903E+00 4.149577E+02 2.063878E+04 1.708241E+00 4.151563E+02 2.065359E+04 1.726053E+00 4.153549E+02 2.024562E+04 1.586455E+00 4.155534E+02 2.008950E+04 1.540441E+00 4.157520E+02 2.000726E+04 1.521473E+00 4.159506E+02 1.979721E+04 1.454846E+00 4.161491E+02 1.964279E+04 1.408557E+00 4.163477E+02 1.941042E+04 1.332865E+00 4.165463E+02 1.932006E+04 1.310718E+00 4.167449E+02 1.917306E+04 1.266979E+00 4.169434E+02 1.925645E+04 1.309883E+00 4.171420E+02 1.913525E+04 1.275764E+00 4.173406E+02 1.905550E+04 1.257451E+00 4.175392E+02 1.905007E+04 1.266937E+00 4.177377E+02 1.889787E+04 1.220978E+00 4.179363E+02 1.898695E+04 1.266342E+00 4.181349E+02 1.887100E+04 1.233945E+00 4.183334E+02 1.887380E+04 1.246402E+00 4.185320E+02 1.852935E+04 1.126909E+00 4.187306E+02 1.838379E+04 1.082862E+00 4.189291E+02 1.834613E+04 1.079584E+00 4.191277E+02 1.829850E+04 1.072646E+00 4.193759E+02 1.820993E+04 1.052433E+00 4.195745E+02 1.799774E+04 9.817437E-01 4.197731E+02 1.798860E+04 9.888789E-01 4.199716E+02 1.788472E+04 9.595119E-01 4.201702E+02 1.775417E+04 9.199095E-01 4.203688E+02 1.754558E+04 8.497652E-01 4.205674E+02 1.742946E+04 8.154104E-01 4.207659E+02 1.740842E+04 8.176833E-01 4.209645E+02 1.734569E+04 8.038592E-01 4.211631E+02 1.724378E+04 7.745637E-01 4.213616E+02 1.725500E+04 7.893232E-01 4.215602E+02 1.707220E+04 7.284163E-01 4.217588E+02 1.695134E+04 6.915525E-01 4.219574E+02 1.675790E+04 6.259608E-01 4.221559E+02 1.672458E+04 6.232222E-01 4.223545E+02 1.688944E+04 6.978787E-01 4.225531E+02 1.679097E+04 6.693290E-01 4.227516E+02 1.672112E+04 6.517235E-01 4.229502E+02 1.680696E+04 6.954930E-01 4.231488E+02 1.671722E+04 6.704511E-01 4.233474E+02 1.652933E+04 6.066297E-01 4.235459E+02 1.646253E+04 5.900164E-01 4.237445E+02 1.648404E+04 6.084457E-01 4.239182E+02 1.654841E+04 6.428543E-01 4.241664E+02 1.646493E+04 6.220406E-01 4.244146E+02 1.636126E+04 5.934737E-01 4.246628E+02 1.637399E+04 6.108655E-01 4.249110E+02 1.623879E+04 5.693818E-01 4.251592E+02 1.637203E+04 6.349294E-01 4.254074E+02 1.628603E+04 6.127053E-01 4.256556E+02 1.611882E+04 5.577958E-01 4.259039E+02 1.624697E+04 6.217537E-01 4.261521E+02 1.619810E+04 6.144157E-01 4.264003E+02 1.610345E+04 5.883357E-01 4.266485E+02 1.599163E+04 5.555196E-01 4.268967E+02 1.602050E+04 5.792583E-01 4.271449E+02 1.598730E+04 5.777334E-01 4.273932E+02 1.593845E+04 5.702788E-01 4.276414E+02 1.570297E+04 4.866464E-01 4.278896E+02 1.600244E+04 6.205086E-01 4.281874E+02 1.585912E+04 5.765070E-01 4.284356E+02 1.589638E+04 6.038005E-01 4.286839E+02 1.565934E+04 5.189289E-01 4.289321E+02 1.564345E+04 5.245180E-01 4.291803E+02 1.570477E+04 5.617083E-01 4.294285E+02 1.554946E+04 5.096158E-01 4.296767E+02 1.554829E+04 5.210202E-01 4.299249E+02 1.550291E+04 5.143124E-01 4.301732E+02 1.556657E+04 5.525188E-01 4.304214E+02 1.561976E+04 5.864099E-01 4.306696E+02 1.549994E+04 5.486185E-01 4.309178E+02 1.542922E+04 5.312156E-01 4.311660E+02 1.546655E+04 5.585932E-01 4.314142E+02 1.540567E+04 5.452376E-01 4.316624E+02 1.547522E+04 5.860921E-01 4.319106E+02 1.533105E+04 5.376003E-01 4.321589E+02 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1.326394E+04 4.905355E-01 4.517181E+02 1.323654E+04 4.878376E-01 4.519664E+02 1.324639E+04 5.030438E-01 4.522146E+02 1.331375E+04 5.464715E-01 4.524628E+02 1.324099E+04 5.219744E-01 4.527110E+02 1.301004E+04 4.203835E-01 4.529592E+02 1.313825E+04 4.930130E-01 4.532074E+02 1.318079E+04 5.242801E-01