Dissociative Excitation of the Odd Sextet Levels of the Cobalt Atom by Collisions of Electrons with Cobalt Dichloride Molecules

Inelastic collisions of slow electrons with cobalt dichloride molecules, leading to the formation of excited cobalt atoms in odd sextet states, are experimentally studied. At an incident electron energy of 100 eV, thirty six dissociative excitation cross sections are measured for levels belonging to the z⁶D°, z⁶F°, and z⁶G° terms. In the electron energy range of 0–100 eV, ten optical excitation functions are recorded. The full cross sections for the dissociative excitation of the cobalt atom levels and the contribution of cascade transitions to their population are determined. The cross sections for electron–molecule and electron–atom collisions are compared.     

Total cross sections for electron scattering from sulfur compounds

The original additivity rule method cannot give good results for electron scattering from SO,SO2,SO2Cl2,SO2ClF,and SO2F2 molecules at low energy,because the electron-molecule scattering is simply reduced to electron-atom scattering.Considering the difference between the bound atom in a molecule and the corresponding free atom,the original additivity rule is revised.With the revised additivity rule,the total cross sections for electron scattering from these molecules are calculated over a wide energy range below 3000 eV and compared with the available experimental and theoretical data.A better agreement between them is obtained.     

Additivity Rule for Electron-Molecule Total Cross Section Calculations at 50-5000 eV： A Geometrical Approach

To quantify the changes of the geometric shielding effect in a molecule as the incident electron energy varies, we present an empirical fraction, which represents the total cross section （TCS） contributions of shielded atoms in a molecule at different energies. Using this empirical fraction, a new formulation of the additivity rule is proposed. Using this new additivity rule, the TCSs for electron scattering by CO2, C2H2, C6H12 （cyclo-hexane） and CsH16 （cyclo-octane） are calculated in the range 50-5000 e V. Here the atomic cross sections are derived from the experimental TCS results of simple molecules （H2, O2, CO）. The quantitative TCSs are compared with those obtained by experiments and other theories, and good agreement is attained over a wide energy range.     

The dissociative excitation of cobalt atom even sextet levels in collisions of electrons with CoCl2 molecules

The cross sections of dissociative excitation of 46 transitions from cobalt atom even sextet levels in collisions of electrons with CoCl₂ molecules were measured at an exciting electron energy of 100 eV. The dissociative and direct CoI excitation cross sections were compared. The results were used to calculate the total cross sections of dissociative excitation of CoI levels at an electron energy of 100 eV. Possible reaction channels at low electron energies are discussed.     

Electronic excitation of Ar atoms to metastable states and from metastable to higher states

The formation of the metastable states 3p ⁵4s of the Ar atom by an electron impact and the electronic excitation from these states to the higher levels 3p ⁵4p ArI are investigated in detail. The electronic excitation cross sections are determined based on a previously proposed approach to generalization of experimental and theoretical results. The method proposed consists in interpolation over the entire set of cross sections for each of the investigated levels of the Ar atom (measured by us previously or taken from the literature) using the four-parameter approximation of the dependences of the cross sections on the energy of incident electrons.     

Ionization of nitrogen,oxygen, water,and carbon dioxide molecules by near-threshold electron impact

An experimental technique for measuring the cross sections of direct and dissociative ionization of N₂, O₂, H₂O, and CO₂ molecules by electron impact in the near-threshold energy range is described. The setup used in the experiments allows mass separation of ions with a monopole mass spectrometer. It is shown that such a setup can be used to advantage in separation experiments. For incident electron energies between 7 and 35 eV, the energy dependences of the cross sections of generation of parent ions and ion fragments due to parent molecule dissociation are obtained.     

Electron impact ionization cross sections of the CO2 clusters

The modified Jain–Khare semi-empirical formalism for the evaluation of differential and integral electron impact ionization cross sections for molecules has been extended to the evaluation of cross sections for the electron ionization of CO₂ clusters: (CO₂)₂₄₀ and (CO₂)₁₇₀₀. The energy dependent differential cross sections are evaluated at the incident electron energies of 50, 100 and 200 eV. The integral total ionization cross sections have been calculated in the energy range varying from ionization thresholds to 1000 eV which revealed a good agreement with the available experimental and the theoretical data. The ionization rate coefficients have also been evaluated using the presently calculated ionization cross sections and Maxwell–Boltzmann energy distributions.     

A semi-empirical formula for total cross sections of electron scattering from diatomic molecules

A fitting formula based on the Born approximation is used to fit the total cross sections for electron scattering by diatomic molecules (CO, N₂, NO, O₂ and HCl) in the intermediate- and high-energy range. By analyzing the fitted parameters and the total cross sections, we found that the internuclear distance of the constituent atoms plays an important role in the e-diatomic molecule collision process. Thus a new semi-empirical formula has been obtained. There is no free parameter in the formula, and the dependence of the total cross sections on the internuclear distance has been reflected clearly. The total cross sections for electron scattering by CO, N₂, NO, O₂ and HCl have been calculated over an incident energy range of 10–4000 eV. The results agree well with other available experimental and calculation data.     

Cross sections for electron collision with five-membered ring heterocycles

The absolute total cross-section (TCS) for electron scattering from isoxasole, (CH)₃NO, molecule has been measured using the linear transmission technique for impact energies ranging from 1 to 400 eV. The measured TCS energy dependence appears typical for highly polar targets; over whole energy range applied, the magnitude of TCS generally decreases as the energy increases. Some narrow features located near 1.2 and 2.7 eV have been observed in the TCS curve as well as a broad enhancement spanned between 5 and 15 eV. The TCS for electron-isoxazole scattering has been compared with TCS data for furan, (CH)₄O; differences and similarities in the appearance of both TCSs energy functions are indicated and discussed. In addition, for several five-membered ring heterocycle molecules: isoxazole, pyrrole [(CH)₄NH] and tiophene [(CH)₄S], integral elastic (ECS) and ionization (ICS) cross sections have been calculated at intermediate and high electron-impact energies in the additivity rule approximation and the binary-encounter-Bethe approach, respectively. For isoxazole and furan the sums of ECS and ICS are in very good agreement with the respective measured TCSs above 50 − 60 eV.     

Total cross sections for electrons scattering from simple molecules containing the larger atom sulfur at 30-5000eV

A complex optical model potential modified by the concept of bonded atom, which takes into consideration the overlapping effect of electron clouds, is employed to calculate the total cross sections for electrons scattering from simple molecules （SO2, H2S, OCS, CS2 and SO3） containing the larger atom, sulfur, at 30-5000eV by using the additivity rule model at Hartree-Fock level. The quantitative molecular total cross section results are compared with those obtained in experiments and other calculations wherever available, and good agreement is obtained. It is shown that the additivity rule model together with the complex optical model potential modified by the concept of bonded atom can give the results closer to the experiments than the one unmodified by it. So, the introduction of bonded-atom concept in complex optical model potential betters the accuracy of the total cross section calculations of electrons from the molecules containing the larger atom, sulfur.     

一种考虑几何屏蔽效应的计算“电子-分子”散射总截面的可加性规则修正方法

在考虑分子内原子间的几何屏蔽效应随电子入射能量变化的基础上, 提出了一种能够在中、高能区准确计算“电子-分子”散射总截面的可加性规则修正方法. 利用这一修正后的可加性规则并使用“电子-C, H, O, N原子”散射总截面的实验数据, 在50—5000 eV内计算了电子被NO, N₂O, NO₂和C₂H₆分子散射的总截面, 且将计算结果与实验结果及其他理论结果进行了比较. 结果表明, 利用这一方法修正过的可加性规则进行计 关键词： 电子散射 可加性规则 总截面 几何屏蔽效应     

Oxygen inducedK-shell ionization of selected elements from sulphur to bromine

K-shell X-ray production cross sections for oxygen ions on thin solid targets of 13 selected elements with atomic numbers between 16 and 35 were measured by a Si(Li) detector at incident ion energies from 7 to 24 MeV. Ionization cross sections are compared with calculations assuming Coulomb-ionization. Best agreement is found with theoretical cross sections that include corrections for binding energy and Coulomb deflection effects. Energy shifts ofK _α andK _β X-rays andK _α /K _β intensity ratios were also measured and are used to deduce information about outer shell ionization.     

Total electron scattering cross section of C3F6O at the intermediate-energy region for developing an alternative insulation gas to SF6

Perfluoro methyl vinyl ether (C₃F₆O) is a promising alternative gas to SF₆ for switching applications in the power industry. We measured the total electron scattering cross section (TCS) of C₃F₆O in the intermediate energy region from 15 to 90 eV using a magnetized electron beam apparatus. The overall TCS values were less than 20.8 × 10⁻¹⁶ cm² within the measuring energy region. The measured and observed TCS exhibited some features, a steep increase before 30 eV, the highest value near 30 eV, and a gradual decrease after 30 eV. The total uncertainty was evaluated as 3.5–8.5%, depending on the incident electron energies. These first measurement data of C₃F₆O are useful for understanding both the discharging characteristics and identifying the insulation properties and arc-extinguishing.     

Quantum-mechanical high temperature Equation of state: Perturbation theory with finite range Kac potential

Angular distribution measurements of reactive scattering of a supersonic potassium atom beam by a series of halogen and halomethane molecules are reported with initial kinetic energies E ～ 5–6 kcal mol^-1. Differential reaction cross sections for I₂, IBr, CH₂I₂ show decreased wide-angle scattering and decreased total reaction cross sections compared with thermal energies. The differential reaction cross section for CHI₃ is peaked in the forward direction (?=0°) but that for CBr₄ peaks sideways at ? ～ 40°. The variation in reaction dynamics is correlated with the potential energy curves of halomethane molecules and their anions as indicated by dissociative thermal electron attachment experiments.     

50—5000 eV电子被C4H8O,C5H10O2, C6H5CH3和C4H8O2散射的总截面

使用电子被C, H和O原子散射总截面的实验数据, 利用修正后的可加性规则计算了能量为50—5000eV的电子被4个复杂大分子C₄H₈O, C₅H₁₀O₂, C₆H₅CH₃和C₄H₈O₂散射的总截面, 并将计算结果与实验结果及其他理论计算结果进行了比较. 结果表明, 即 关键词： 电子散射 可加性规则 总截面 几何屏蔽效应     

Two Components of the Total Ionization Cross Sections of Atoms and Molecules by Electron Impact: Resonant Excitation and Decay of the Fermi Electron-Hole System and the Dipole Electron Transition from a Bound to a Free State at a Binary Collision

Large volume of the experimental data on the ionization cross sections of atoms and molecules by electron impact obtained by various authors using different methods is analyzed. The dependence of the ionization cross section Q on the energy of the incident electron E is described by a curve with a maximum. For E I, where I is the ionization potential, the cross section naturally vanishes. For E > I, it first increases fast, passes through a high maximum, and then monotonically decreases with increasing E. For comparatively large energies E > 100 I, the Bethe formula describes the experimental data almost exactly, but in the region of maximum I < E < 10 I, it deviates significantly from the measurement data. In the present paper it has been established that the experimental dependence Q(E) in the region of maximum is well described by a resonant curve similar to Lorentz distribution. It is assumed that the main contribution to the atomic ionization by a slow electron comes from the resonant excitation and the decay of the Fermi electron-hole system. An empirical formula for the cross section of atom ionization by electron impact Q(E) is suggested which takes into account resonance for incident electrons of small energies and is transformed into the Bethe formula for large E. The parameters of the formula for the ionization cross section are calculated by the least-squares method for H, He, Ne, Ar, C, N, O, Li, Na, H₂, N₂, O₂, K-shells of C, N, Ne, Ar, K, Ca, Rb, and Sr atoms and molecules. A comparison of the experimental dependences of the ionization cross section on the energy of the incident electron with the Bethe theoretical formula and empirical formulas suggested by Lotz, Alkhazov, Kim and Rudd, and Povyshev et al. demonstrates that the formula suggested in the present paper describes the available experimental data better than others.     

Inelastic collisions of slow electrons with SrBr<Subscript>2</Subscript> molecules

Inelastic collisions of slow electrons with SrBr₂ molecules were studied experimentally. The dissociative excitation cross sections of two lines of the strontium atom and eight lines of the singly charged strontium ion were measured. Six optical excitation functions were recorded over the electron energy range 0–100 eV. Dissociative excitation cross sections were also measured for two strontium monobromide sequences related to the B ²Σ⁺-X ²Σ⁺ system.     

不同能量的氦原子与同位素分子H2(D2，T2)碰撞分波截面的理论计算

用Tang-Toennies势模型和密耦近似方法计算了不同能量下惰性气体原子He与H₂及其同位素D₂,T₂替代碰撞体系的振转激发碰撞截面. 通过分析He-H₂(D₂,T₂)各碰撞体系分波截面的差异,总结出在H₂分子的对称同位素替代情形下He-H₂(D₂,T₂)碰撞体系分波截面随量子数和体系 关键词： 散射截面 密耦方法 同位素     

Total cross sections for electron scattering from fluoromethanes: A revised additivity rule method

The additivity rule for electron-molecule scattering is revised by considering the difference between the free atom and the bound atom in the molecule.The total cross sections for electron scattering from fluoromethanes(CF4,CF3H,CF2H2,and CFH3) are calculated in an energy range from 100 eV to 1500 eV by the revised additivity rule.The present calculations are compared with the original additivity rule results and the available experimental data.Better agreement with each other is obtained.     

Total cross sections of electron scattering by several sulfur-containing molecules OCS, SO2, SF4, SF6, SF5CF3, SO2Cl2 and SO2ClF at 30–5000?eV

Total cross sections of electron scattering by several sulfur-containing molecules OCS, SO₂, SF₄, SF₆, SF₅CF₃, SO₂Cl₂ and SO₂ClF are calculated at the Hartree-Fork level employing the modified additivity rule approach. The modified additivity rule approach, which was proposed by Shi et al. [Eur. Phys. J. D 45, 253 (2007); Nucl. Instrum. Meth. B 254, 205 (2007)], takes into consideration that the contributions of the geometric shielding effect vary as the energy of incident electrons, the target’s molecular dimension and the atomic and electronic numbers in the molecule. The present investigations cover the impact energies ranging from 30 to 5000 eV. The quantitative total cross sections are compared with those obtained by experiments and other theories. Good agreement is observed even at energies of several tens of eV. It shows that the modified additivity rule approach is applicable to carry out the total cross section calculations of electron scattering by these sulfur-containing molecules at intermediate and high energies, especially over the energy range above 100 eV or so. In the present calculations, the atoms are still represented by the spherical complex optical potential, which is composed of static, exchange, polarization and absorption terms.