Hidetoshi Kato

Substitution effects in elastic electron collisions with CH3X (X=F, Cl, Br, I) molecules

We report absolute elastic differential, integral, and momentum transfer cross sections for electron interactions with the series of molecules CH(3)X (X=F, Cl, Br, I). The incident electron energy range is 50-200 eV, while the scattered electron angular range for the differential measurements is 15 degrees-150 degrees. In all cases the absolute scale of the differential cross sections was set using the relative flow method with helium as the reference species. Substitution effects on these cross sections, as we progress along the halomethane series CH(3)F, CH(3)Cl, CH(3)Br, and CH(3)I, are investigated as a part of this study. In addition, atomic-like behavior in these scattering systems is also considered by comparing these halomethane elastic cross sections to results from other workers for the corresponding noble gases Ne, Ar, Kr, and Xe, respectively. Finally we report results for calculations of elastic differential and integral cross sections for electrons scattering from each of the CH(3)X species, within an optical potential method and assuming a screened corrected independent atom representation. The level of agreement between these calculations and our measurements was found to be quite remarkable in each case.

A study of electron scattering from benzene: Excitation of the 1B1u, 3E2g, and 1E1u electronic states

We report results from measurements for differential and integral cross sections of the unresolved (1)B(1u) and (3)E(2g) electronic states and the (1)E(1u) electronic state in benzene. The energy range of this work was 10-200 eV, while the angular range of the differential cross sections was ∼3°-130°. To the best of our knowledge there are no other corresponding theoretical or experimental data against which we can compare the present results. A generalized oscillator strength analysis was applied to our 100 and 200 eV differential cross section data, for both the (1)B(1u) and (1)E(1u) states, with optical oscillator strengths being derived in each case. The respective optical oscillator strengths were found to be consistent with many, but not all, of the earlier theoretical and experimental determinations. Finally, we present theoretical integral cross sections for both the (1)B(1u) and (1)E(1u) electronic states, as calculated within the BEf-scaling formalism, and compare them against relevant results from our measurements. From that comparison, an integral cross section for the optically forbidden (3)E(2g) state is also derived.

Electron excitation of the Schumann–Runge continuum, longest band, and second band electronic states in O2

We report measurements of differential and integral cross sections for electron excitation of the Schumann-Runge continuum, longest band, and second band electronic states in molecular oxygen. The energy range of the present study is 15-200 eV, with the angular range of the differential cross section (DCS) measurements from 2 to 130°. A generalized oscillator strength analysis is then employed in order to derive integral cross sections (ICSs) from the corresponding DCSs, and these ICSs are compared with relevant energy and oscillator strength scaled Born cross section (BEf-scaling [Y.-K. Kim, J. Chem. Phys. 126, 064305 (2007)]) results determined as a part of this investigation. Interestingly, while the present Schumann-Runge continuum and second band ICSs were in reasonable agreement with the respective BEf-scaling results, agreement for the longest band was poor below 100 eV with a possible reason for this apparently anomalous behavior being canvassed here. Finally, where possible all present data are compared with the results from earlier measurements and calculations with the level of agreement found being very good in some cases and marginal in others.

Electronic states of F2CO as studied by electron energy-loss spectroscopy and ab initio calculations.

This paper reports on the first measurements of the electron impact electronic excitation cross-sections for carbonyl fluoride, F(2)CO, measured at 30 eV, 10° and 100 eV, 5° scattering angle, while sweeping the energy loss over the range 5.0-18.0 eV. The electronic-state spectroscopy has been investigated and the assignments are supported by quantum chemical calculations. The energy bands above 9.0 eV and the vibrational progressions superimposed upon it have been observed for the first time. Vibronic coupling has been shown to play an important role dictating the nature of the observed excited states, especially for the low-lying energy region (6.0-8.0 eV). New experimental evidence for the 6(1)B(2) state proposed to have its maximum at 12.75 eV according to the vibrational excitation reported in this energy region (11.6-14.0 eV). The n = 3 members of the Rydberg series have been assigned converging to the lowest ionization energy limits, 13.02 eV ((2)B(2)), 14.09 eV ((2)B(1)), 16.10 ((2)B(2)), and 19.15 eV ((2)A(1)) reported for the first time and classified according to the magnitude of the quantum defects (δ).

Experimental Study of C3F6 Electron Impact Spectroscopy

This paper reports on the first measurements of the electron impact electronic excitation cross sections for hexafluoropropene (C3F6) measured at the two experimental conditions of 20 eV and 10°, and 100 eV and 5°, while sweeping the energy loss over the range 2–14 eV. Similarity between these two spectra shows the insignificance of optically forbidden transitions in these molecules. Three broad features have been observed at about 7, 7.5, and 8.2 eV and attributed to the C=Cπ→C–Fσ*; C=Cπ→C=Cσ* (both dissociative); and 8.2 eV, due to C=Cπ→C=Cπ* excitations. The EELS for impact energy 100 eV and angle 5° rise rapidly above 11 eV and shows a broad resonance structure centered around 12.7 eV. Similarities in the repulsive energy loss features have been observed in the comparative study of the C3F6 EELS for 100 eV, 5° with the similar one for C2F4 and attributed to the common electronic transitions into C=C antibonding orbitals, albeit with peak position differences below 10 eV.