********************* Core Excitation Data ******************** **************** A.P. Hitchcock & D.C. Mancini **************** * * Formula: CF3OOCF3 * Name: Bis(trifluoromethyl) peroxide * Edge: F 1s * Alpha Formula: C2F6O2 * Data Source: Hitchcock * Filename: px-0ffkk.os * Ref. Code: MI&87 * Write Date: 93/06/10 * Reference: J.Chem.Phys. 87 (87) 4344. * Source and Purity: PCR * Acquisition Mode: EELS, 2 deg., 2500 eV CRE, 0.7 eV fwhm *-------------------------------------------------------------- * No. of Spectra: 2 name1- 0pxf5. name2- 0pxf.os * E (eV) Raw data Osc. Str. per atom (E-2) *-------------------------------------------------------------- 6.722712E+02 6.956000E+03 -6.658470E-04 6.724672E+02 6.920000E+03 -3.337118E-03 6.726632E+02 6.895000E+03 -5.088571E-03 6.728593E+02 6.958000E+03 5.209307E-04 6.730552E+02 7.100000E+03 1.273838E-02 6.732502E+02 6.828000E+03 -9.677082E-03 6.734462E+02 7.077000E+03 1.149025E-02 6.736422E+02 6.849000E+03 -7.243527E-03 6.738383E+02 6.923000E+03 -7.153506E-04 6.740342E+02 6.915000E+03 -1.046804E-03 6.742292E+02 6.920000E+03 -2.928142E-04 6.744252E+02 6.927000E+03 6.298630E-04 6.746212E+02 6.958000E+03 3.559843E-03 6.748172E+02 6.832000E+03 -6.643480E-03 6.750132E+02 6.929000E+03 1.806879E-03 6.752083E+02 6.883000E+03 -1.706687E-03 6.754042E+02 6.917000E+03 1.473057E-03 6.756002E+02 6.945000E+03 4.150618E-03 6.757962E+02 6.974000E+03 6.911502E-03 6.759922E+02 6.647000E+03 -2.010697E-02 6.761873E+02 6.911000E+03 2.309307E-03 6.763832E+02 6.966000E+03 7.244262E-03 6.765792E+02 6.927000E+03 4.315834E-03 6.767752E+02 6.994000E+03 1.025397E-02 6.769713E+02 6.925000E+03 4.815607E-03 6.771662E+02 6.850000E+03 -1.126818E-03 6.773622E+02 6.867000E+03 6.280659E-04 6.775582E+02 6.970000E+03 9.576442E-03 6.777542E+02 6.849000E+03 -2.129632E-04 6.779503E+02 6.872000E+03 2.042960E-03 6.781452E+02 6.818000E+03 -2.144255E-03 6.783412E+02 6.825000E+03 -1.227295E-03 6.785372E+02 6.870000E+03 2.867978E-03 6.787332E+02 6.769000E+03 -5.249866E-03 6.789292E+02 6.735000E+03 -7.763518E-03 6.791242E+02 6.685000E+03 -1.161744E-02 6.793203E+02 6.826000E+03 5.071253E-04 6.795162E+02 6.896000E+03 6.692166E-03 6.797122E+02 6.754000E+03 -4.856738E-03 6.799082E+02 6.910000E+03 8.521592E-03 6.801032E+02 6.951000E+03 1.227835E-02 6.802993E+02 6.645000E+03 -1.298986E-02 6.804952E+02 6.871000E+03 6.243122E-03 6.806912E+02 6.779000E+03 -1.124735E-03 6.808872E+02 6.792000E+03 2.903227E-04 6.810822E+02 6.704000E+03 -6.745142E-03 6.812782E+02 6.830000E+03 4.121741E-03 6.814742E+02 6.764000E+03 -1.072250E-03 6.816702E+02 6.697000E+03 -6.350298E-03 6.818662E+02 6.804000E+03 2.926386E-03 6.820612E+02 6.631000E+03 -1.122068E-02 6.822572E+02 6.699000E+03 -5.206898E-03 6.824532E+02 6.722000E+03 -2.957468E-03 6.826492E+02 6.699000E+03 -4.556367E-03 6.828452E+02 6.782000E+03 2.711339E-03 6.830402E+02 6.694000E+03 -4.326902E-03 6.832362E+02 6.844000E+03 8.544751E-03 6.834323E+02 6.828000E+03 7.530419E-03 6.836282E+02 6.756000E+03 1.831345E-03 6.838242E+02 6.758000E+03 2.322051E-03 6.840192E+02 6.742000E+03 1.305145E-03 6.842152E+02 6.679000E+03 -3.641941E-03 6.844113E+02 6.767000E+03 4.041890E-03 6.846072E+02 6.734000E+03 1.603759E-03 6.848032E+02 6.618000E+03 -7.777569E-03 6.849982E+02 6.687000E+03 -1.685612E-03 6.851942E+02 6.653000E+03 -4.208250E-03 6.853903E+02 6.733000E+03 2.804996E-03 6.855862E+02 6.682000E+03 -1.140215E-03 6.857822E+02 6.828000E+03 1.139325E-02 6.859772E+02 6.777000E+03 7.445870E-03 6.861732E+02 6.854000E+03 1.420698E-02 6.863692E+02 6.796000E+03 9.675123E-03 6.865652E+02 6.903000E+03 1.894523E-02 6.867612E+02 6.735000E+03 5.211391E-03 6.869562E+02 6.987000E+03 2.660848E-02 6.871522E+02 7.121000E+03 3.813623E-02 6.873482E+02 7.396000E+03 6.145827E-02 6.875443E+02 7.366000E+03 5.926708E-02 6.877402E+02 7.575000E+03 7.706773E-02 6.879352E+02 7.927000E+03 1.068284E-01 6.881312E+02 8.238000E+03 1.331607E-01 6.883272E+02 8.661000E+03 1.688616E-01 6.885233E+02 9.308000E+03 2.232997E-01 6.887192E+02 9.342000E+03 2.264604E-01 6.889142E+02 9.739000E+03 2.599839E-01 6.891102E+02 1.020400E+04 2.991970E-01 6.893062E+02 1.075000E+04 3.451854E-01 6.895023E+02 1.121100E+04 3.840633E-01 6.896982E+02 1.164200E+04 4.204314E-01 6.898932E+02 1.207000E+04 4.565468E-01 6.900892E+02 1.250800E+04 4.935000E-01 6.902852E+02 1.317800E+04 5.498595E-01 6.904812E+02 1.358100E+04 5.838844E-01 6.906772E+02 1.454700E+04 6.650039E-01 6.908723E+02 1.526100E+04 7.250416E-01 6.910682E+02 1.618800E+04 8.028980E-01 6.912642E+02 1.756300E+04 9.182292E-01 6.914602E+02 1.903900E+04 1.042009E+00 6.916563E+02 2.005500E+04 1.127309E+00 6.918513E+02 2.141300E+04 1.241216E+00 6.920472E+02 2.278000E+04 1.355877E+00 6.922432E+02 2.351500E+04 1.417671E+00 6.924392E+02 2.388800E+04 1.449184E+00 6.926353E+02 2.391600E+04 1.451837E+00 6.928302E+02 2.381300E+04 1.443531E+00 6.930262E+02 2.379300E+04 1.442168E+00 6.932222E+02 2.318100E+04 1.391285E+00 6.934182E+02 2.307500E+04 1.382729E+00 6.936143E+02 2.254100E+04 1.338370E+00 6.938092E+02 2.216900E+04 1.307560E+00 6.940052E+02 2.175200E+04 1.272988E+00 6.942012E+02 2.116100E+04 1.223860E+00 6.943972E+02 2.068800E+04 1.184602E+00 6.945932E+02 1.973600E+04 1.105277E+00 6.947882E+02 1.908000E+04 1.050709E+00 6.949843E+02 1.833600E+04 9.887822E-01 6.951802E+02 1.790600E+04 9.531208E-01 6.953762E+02 1.707200E+04 8.836645E-01 6.955722E+02 1.637900E+04 8.260027E-01 6.957672E+02 1.571700E+04 7.709323E-01 6.959633E+02 1.489700E+04 7.026464E-01 6.961592E+02 1.436500E+04 6.584514E-01 6.963552E+02 1.420400E+04 6.452900E-01 6.965512E+02 1.376500E+04 6.088738E-01 6.967462E+02 1.334400E+04 5.739615E-01 6.969422E+02 1.283100E+04 5.313548E-01 6.971382E+02 1.270100E+04 5.207856E-01 6.973342E+02 1.244100E+04 4.993417E-01 6.975302E+02 1.230200E+04 4.880191E-01 6.977252E+02 1.204400E+04 4.667404E-01 6.979212E+02 1.182900E+04 4.490600E-01 6.981172E+02 1.180000E+04 4.469381E-01 6.983132E+02 1.149700E+04 4.218960E-01 6.985092E+02 1.161300E+04 4.319027E-01 6.987042E+02 1.155000E+04 4.269345E-01 6.989002E+02 1.134800E+04 4.103401E-01 6.990963E+02 1.125500E+04 4.028634E-01 6.992922E+02 1.114300E+04 3.937970E-01 6.994882E+02 1.130200E+04 4.073994E-01 6.996832E+02 1.131500E+04 4.087872E-01 6.998792E+02 1.123200E+04 4.021460E-01 7.000753E+02 1.115500E+04 3.960064E-01 7.002712E+02 1.114000E+04 3.950528E-01 7.004672E+02 1.127100E+04 4.063117E-01 7.006622E+02 1.101800E+04 3.854475E-01 7.008582E+02 1.119800E+04 4.008047E-01 7.010542E+02 1.096500E+04 3.816145E-01 7.012502E+02 1.093600E+04 3.794887E-01 7.014462E+02 1.103000E+04 3.876513E-01 7.016412E+02 1.092500E+04 3.791659E-01 7.018372E+02 1.092900E+04 3.797996E-01 7.020332E+02 1.095200E+04 3.820224E-01 7.022292E+02 1.102600E+04 3.885112E-01 7.024252E+02 1.112600E+04 3.971744E-01 7.026202E+02 1.093600E+04 3.815776E-01 7.028162E+02 1.087200E+04 3.765219E-01 7.030122E+02 1.102000E+04 3.891996E-01 7.032083E+02 1.093400E+04 3.823032E-01 7.034042E+02 1.093100E+04 3.823494E-01 7.034933E+02 1.103853E+04 3.914790E-01 7.037952E+02 1.094100E+04 3.837779E-01 7.039912E+02 1.097400E+04 3.868347E-01 7.041873E+02 1.079200E+04 3.719066E-01 7.043832E+02 1.105200E+04 3.939513E-01 7.045792E+02 1.091600E+04 3.828706E-01 7.047742E+02 1.099400E+04 3.896892E-01 7.049702E+02 1.100000E+04 3.904862E-01 7.051662E+02 1.084800E+04 3.780664E-01 7.053622E+02 1.094500E+04 3.864751E-01 7.055582E+02 1.107100E+04 3.973093E-01 7.057532E+02 1.100900E+04 3.924157E-01 7.059492E+02 1.092800E+04 3.859340E-01 7.061452E+02 1.101200E+04 3.932542E-01 7.063412E+02 1.100300E+04 3.927948E-01 7.065372E+02 1.097900E+04 3.910804E-01 7.067322E+02 1.098000E+04 3.914555E-01 7.069282E+02 1.075300E+04 3.727597E-01 7.071242E+02 1.085900E+04 3.819190E-01 7.073203E+02 1.095000E+04 3.898234E-01 7.075162E+02 1.100600E+04 3.947997E-01 7.077112E+02 1.084600E+04 3.817060E-01 7.079072E+02 1.094100E+04 3.899442E-01 7.081032E+02 1.103000E+04 3.976802E-01 7.082993E+02 1.094600E+04 3.909447E-01 7.084952E+02 1.077500E+04 3.769314E-01 7.086902E+02 1.098800E+04 3.950377E-01 7.088862E+02 1.087800E+04 3.861266E-01 7.090822E+02 1.100900E+04 3.973746E-01 7.092782E+02 1.102600E+04 3.990864E-01 7.094742E+02 1.089200E+04 3.881670E-01 7.096693E+02 1.094400E+04 3.928047E-01 7.098652E+02 1.099400E+04 3.972762E-01 7.100612E+02 1.085400E+04 3.858541E-01 7.102572E+02 1.068500E+04 3.720059E-01 7.104532E+02 1.076300E+04 3.788189E-01 7.106483E+02 1.083400E+04 3.850447E-01 7.108442E+02 1.079400E+04 3.819865E-01 7.110402E+02 1.076400E+04 3.797647E-01 7.112362E+02 1.062200E+04 3.681738E-01 7.114323E+02 1.053000E+04 3.607653E-01 7.116273E+02 1.081300E+04 3.847236E-01 7.118232E+02 1.083900E+04 3.871851E-01 7.120192E+02 1.086700E+04 3.898138E-01 7.122152E+02 1.080000E+04 3.844955E-01 7.124113E+02 1.070400E+04 3.767511E-01 7.126062E+02 1.057600E+04 3.663282E-01 7.128022E+02 1.066100E+04 3.737240E-01 7.129982E+02 1.068500E+04 3.760168E-01 7.131942E+02 1.055800E+04 3.656784E-01 7.133903E+02 1.059500E+04 3.690582E-01 7.135852E+02 1.041300E+04 3.541171E-01 7.137813E+02 1.047400E+04 3.595041E-01 7.139772E+02 1.057700E+04 3.684041E-01 7.141732E+02 1.055500E+04 3.668476E-01 7.143692E+02 1.043800E+04 3.573442E-01 7.145642E+02 1.068100E+04 3.779530E-01 7.147603E+02 1.049300E+04 3.625101E-01 7.149562E+02 1.036000E+04 3.516676E-01 7.151522E+02 1.060800E+04 3.726954E-01 7.153482E+02 1.050700E+04 3.645292E-01 7.155432E+02 1.034100E+04 3.509242E-01 7.157393E+02 1.036100E+04 3.528793E-01 7.159352E+02 1.039000E+04 3.555869E-01 7.161312E+02 1.046400E+04 3.620585E-01 7.163272E+02 1.044000E+04 3.603321E-01 7.165222E+02 1.035900E+04 3.538361E-01 7.167182E+02 1.057100E+04 3.718506E-01 7.169142E+02 1.034300E+04 3.530593E-01 7.171102E+02 1.049300E+04 3.658870E-01 7.173062E+02 1.038700E+04 3.573003E-01 7.175012E+02 1.034500E+04 3.540656E-01 7.176972E+02 1.047800E+04 3.654706E-01 7.178932E+02 1.032700E+04 3.531190E-01 7.180892E+02 1.031700E+04 3.525618E-01 7.182852E+02 1.044100E+04 3.632134E-01 7.184802E+02 1.056300E+04 3.736960E-01 7.186762E+02 1.024000E+04 3.469557E-01 7.188723E+02 1.041100E+04 3.615381E-01 7.190682E+02 1.046100E+04 3.659987E-01 7.192642E+02 1.051900E+04 3.711281E-01 7.194592E+02 1.044500E+04 3.652143E-01 7.196552E+02 1.025500E+04 3.495983E-01 7.198513E+02 1.052000E+04 3.720427E-01 7.200472E+02 1.050000E+04 3.706467E-01 7.202432E+02 1.044700E+04 3.664900E-01 7.204382E+02 1.033300E+04 3.572290E-01 7.206342E+02 1.036000E+04 3.597638E-01 7.208302E+02 1.058600E+04 3.789446E-01 7.210262E+02 1.059600E+04 3.800570E-01 7.212222E+02 1.043400E+04 3.667814E-01 7.214172E+02 1.053000E+04 3.750857E-01 7.216132E+02 1.055400E+04 3.773685E-01 7.218092E+02 1.046600E+04 3.702822E-01 7.220052E+02 1.053900E+04 3.766634E-01 7.222012E+02 1.045000E+04 3.694930E-01 7.223962E+02 1.040400E+04 3.659180E-01 7.225922E+02 1.033900E+04 3.607548E-01 7.227882E+02 1.037500E+04 3.640400E-01 7.229843E+02 1.055300E+04 3.792033E-01 7.231802E+02 1.016500E+04 3.470206E-01 7.233752E+02 1.046300E+04 3.722200E-01 7.235712E+02 1.050100E+04 3.756715E-01 7.237672E+02 1.038500E+04 3.662409E-01 7.239633E+02 1.054600E+04 3.799810E-01 7.241592E+02 1.016200E+04 3.481318E-01 7.243542E+02 1.040900E+04 3.690639E-01 7.245502E+02 1.033100E+04 3.628111E-01 7.247462E+02 1.033500E+04 3.634172E-01 7.249422E+02 1.038800E+04 3.681220E-01 7.251382E+02 1.029900E+04 3.609485E-01 7.253333E+02 1.040600E+04 3.701685E-01 7.255292E+02 1.036800E+04 3.672605E-01 7.257252E+02 1.045100E+04 3.744739E-01 7.259212E+02 1.019600E+04 3.534135E-01 7.261172E+02 1.027300E+04 3.601247E-01 7.263123E+02 1.036100E+04 3.677543E-01 7.265082E+02 1.029800E+04 3.627540E-01 7.267042E+02 1.029600E+04 3.628561E-01 7.269002E+02 1.018500E+04 3.538402E-01 7.270963E+02 1.021700E+04 3.567860E-01 7.272912E+02 1.032300E+04 3.659201E-01 7.274872E+02 1.016000E+04 3.525539E-01 7.276832E+02 1.030700E+04 3.651187E-01 7.278792E+02 1.001000E+04 3.405429E-01 7.280753E+02 1.036700E+04 3.706737E-01 7.282702E+02 1.017500E+04 3.548792E-01 7.284662E+02 1.007300E+04 3.466145E-01 7.286622E+02 1.008900E+04 3.482200E-01 7.288582E+02 9.931000E+03 3.352704E-01 7.290542E+02 1.011000E+04 3.505105E-01 7.292492E+02 1.018300E+04 3.568822E-01 7.294453E+02 1.011300E+04 3.512931E-01 7.296412E+02 1.005800E+04 3.469585E-01 7.298372E+02 1.018300E+04 3.576806E-01 7.300332E+02 9.969000E+03 3.400453E-01 7.302282E+02 9.985000E+03 3.416479E-01 7.304243E+02 9.879000E+03 3.330464E-01 7.306202E+02 1.016300E+04 3.570680E-01 7.308162E+02 9.958000E+03 3.401847E-01 7.310122E+02 1.006900E+04 3.497345E-01 7.312072E+02 1.003100E+04 3.468189E-01 7.314032E+02 9.849000E+03 3.318588E-01 7.315992E+02 9.993000E+03 3.441685E-01 7.317952E+02 1.004200E+04 3.485311E-01 7.319912E+02 1.017300E+04 3.597528E-01 7.321862E+02 9.933000E+03 3.399390E-01 7.323822E+02 9.903000E+03 3.376926E-01 7.325782E+02 9.955000E+03 3.423054E-01 7.327742E+02 9.863000E+03 3.348724E-01 7.329702E+02 1.002100E+04 3.483516E-01 7.331652E+02 9.985000E+03 3.456012E-01 7.333612E+02 1.005100E+04 3.513842E-01 7.335573E+02 1.004600E+04 3.512279E-01 7.337532E+02 1.003200E+04 3.503185E-01 7.339492E+02 1.001100E+04 3.488233E-01 7.341442E+02 9.985000E+03 3.469084E-01 7.343402E+02 1.002700E+04 3.506827E-01 7.345363E+02 1.015000E+04 3.612326E-01 7.347322E+02 9.963000E+03 3.458507E-01 7.349282E+02 9.950000E+03 3.450237E-01 7.351232E+02 9.866000E+03 3.382561E-01 7.353192E+02 9.807000E+03 3.335808E-01 7.355153E+02 9.938000E+03 3.447987E-01 7.357112E+02 9.955000E+03 3.464804E-01 7.359072E+02 1.009000E+04 3.580324E-01 7.361022E+02 9.856000E+03 3.387163E-01 7.362982E+02 9.971000E+03 3.485951E-01 7.364942E+02 9.951000E+03 3.471808E-01 7.366902E+02 9.992000E+03 3.508691E-01 7.368862E+02 1.001200E+04 3.528005E-01 7.370812E+02 9.826000E+03 3.374985E-01 7.372772E+02 9.930000E+03 3.464560E-01 7.374732E+02 9.918000E+03 3.457099E-01 7.376693E+02 1.000800E+04 3.534960E-01 7.378652E+02 9.821000E+03 3.381109E-01 7.380602E+02 9.905000E+03 3.453933E-01 7.382562E+02 9.962000E+03 3.504182E-01 7.384522E+02 9.849000E+03 3.412225E-01 7.386483E+02 9.918000E+03 3.472509E-01 7.388442E+02 1.012000E+04 3.644044E-01 7.390392E+02 9.871000E+03 3.438306E-01 7.392352E+02 1.009000E+04 3.624057E-01 7.394312E+02 9.855000E+03 3.430038E-01 7.396273E+02 9.821000E+03 3.404152E-01 7.398232E+02 9.965000E+03 3.527161E-01 7.400182E+02 9.897000E+03 3.472817E-01 7.402142E+02 9.936000E+03 3.507989E-01 7.404102E+02 9.929000E+03 3.504680E-01 7.406062E+02 9.820000E+03 3.416047E-01 7.408022E+02 9.831000E+03 3.427792E-01 7.409973E+02 9.843000E+03 3.440358E-01 7.411932E+02 9.953000E+03 3.534911E-01 7.413892E+02 9.658000E+03 3.290682E-01 7.415852E+02 9.736000E+03 3.358463E-01 7.417813E+02 9.809000E+03 3.422061E-01 7.419763E+02 9.882000E+03 3.485644E-01 7.421722E+02 9.751000E+03 3.378591E-01 7.423682E+02 9.872000E+03 3.482334E-01 7.425642E+02 9.736000E+03 3.371095E-01 7.427603E+02 9.735000E+03 3.372782E-01 7.429552E+02 9.939000E+03 3.545934E-01 7.431512E+02 9.758000E+03 3.397048E-01 7.433472E+02 9.734000E+03 3.379489E-01 7.435432E+02 9.510000E+03 3.194629E-01 7.437393E+02 9.597000E+03 3.269917E-01 7.439342E+02 9.778000E+03 3.423820E-01 7.441302E+02 9.679000E+03 3.343517E-01 7.443262E+02 9.656000E+03 3.326784E-01 7.445222E+02 9.727000E+03 3.388680E-01 7.447182E+02 9.847000E+03 3.491562E-01 7.449132E+02 9.563000E+03 3.256485E-01 7.451093E+02 9.660000E+03 3.340125E-01 7.453052E+02 9.657000E+03 3.340113E-01 7.455012E+02 9.577000E+03 3.275688E-01 7.456972E+02 9.443000E+03 3.166091E-01 7.458922E+02 9.497000E+03 3.213740E-01 7.460883E+02 9.518000E+03 3.233796E-01 7.462842E+02 9.548000E+03 3.261378E-01 7.464802E+02 9.532000E+03 3.250479E-01 7.466762E+02 9.570000E+03 3.284749E-01 7.468712E+02 9.443000E+03 3.180983E-01 7.470672E+02 9.519000E+03 3.247036E-01 7.472632E+02 9.587000E+03 3.306396E-01 7.474592E+02 9.317000E+03 3.083017E-01 7.476552E+02 9.516000E+03 3.251953E-01 7.478502E+02 9.509000E+03 3.248557E-01 7.480462E+02 9.684000E+03 3.397413E-01 7.482422E+02 9.717000E+03 3.427486E-01 7.484382E+02 9.610000E+03 3.340446E-01 7.486342E+02 9.502000E+03 3.252568E-01 7.488292E+02 9.557000E+03 3.301025E-01 7.490252E+02 9.516000E+03 3.269189E-01 7.492213E+02 9.561000E+03 3.309290E-01 7.494172E+02 9.585000E+03 3.331821E-01 7.496132E+02 9.499000E+03 3.262337E-01 7.498082E+02 9.603000E+03 3.351772E-01 7.500042E+02 9.413000E+03 3.195288E-01