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Calculation of Surface Excitation Parameters by a Monte Carlo Method

蒙特卡洛方法计算材料表面激发参数
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摘要 Electron inelastic mean free path (IMFP) is an important parameter for surface chemical quantification by surface electron spectroscopy techniques. It can be obtained from analysis of elastic peak electron spectroscopy (EPES) spectra measured on samples and a Monte Carlo simulation method. To obtain IMFP parameters with high accuracy, the surface excitation effect on the measured EPES spectra has to be quantified as a surface excitation parameter (SEP), which can be calculated via a dielectric response theory. However, such calculated SEP does not include influence of elastic scattering of electrons inside samples during their incidence and emission processes, which should not be neglected simply in determining IMFP by an EPES method. In this work a Monte Carlo simulation method is employed to determine surface excitation parameter by taking account of the elastic scattering effect. The simulated SEPs for different primary energies are found to be in good agreement with the experiments particularly for larger incident or emission angles above 60° where the elastic scattering effect plays a more important role than those in smaller incident or emission angles. Based on these new SEPs, the IMFP measurement by EPES technique can provide more accurate data.
作者 Zhe Zheng Bo Da Shi-feng Mao Ze-jun Ding 郑哲;达博;毛世峰;丁泽军(中国科学技术大学近代物理系,近地空间环境重点实验室,合肥230026;日本国家物质材料研究所,筑波;中国科学技术大学核科学技术学院,合肥230026;中国科学技术大学物理系,合肥微尺度物质科学国家实验室(筹),合肥230026)
出处 《Chinese Journal of Chemical Physics》 SCIE CAS CSCD 2017年第1期83-89,I0002,共8页 化学物理学报(英文)
基金 This work was supported by the National Natural Science Foundation of China (No.11274288 and No.11574289). We thank the Supercomputing Center of USTC for support in performing parallel computations.
关键词 Eelastic peak electron spectroscopy Surface excitation parameter Monte Carlo simulation 弹性峰电子能谱 表面激发参数 蒙特卡洛模拟
分类号 O [理学]
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