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A Modified Potential Method for Electrons Scattering Total Cross Section Calculations on Several Molecules at 30 ~ 5000 eV: CF4, CCl4, CFCl3, CF2Cl2, and CF3Cl

A Modified Potential Method for Electrons Scattering Total Cross Section Calculations on Several Molecules at 30 ~ 5000 eV: CF4, CCl4, CFCl3, CF2Cl2, and CF3Cl
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摘要 A complex optical model potential modified by the concept of bonded atom, which takes into consideration the overlapping effect of electron clouds between two atoms in a molecule, is employed to calculate the total cross sections (TCS5) for electrons scattering from several molecules (CF4, CCl4, CFCl3, CF2 Cl2, and CF3 Cl) over an incident energy range 30 - 5000 eV using the additivity rule model at Hartre-Fock level. The quantitative TCS5 are compared with those obtained by experiments and other theories wherever available, and good agreement is obtained above 100 eV. It is shown that the modified potential can successfully calculate the TCS5 of electron-molecule scattering over a wide energy range, especially at lower energies.
出处 《Communications in Theoretical Physics》 SCIE CAS CSCD 2006年第4期697-701,共5页 理论物理通讯(英文版)
基金 The project supported by National Natural Science Foundation of China under Grant Nos. 10174019 and 10574039
关键词 total cross section additivity rule atomic and molecular collision 交叉截面 添加法则 原子碰撞 分子碰撞
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