Adsorption of Cs-O on Graphene: Modification of the Anderson-Newns Model for the Calculation of Work Function Variation | |
Li, Yukun1,2; Xu, Gang2; Hu, Huiqing2; Cheng, Xiaoyu1,2; Jiang, Zhizhong2 | |
刊名 | JOURNAL OF ELECTRONIC MATERIALS |
2020-11-10 | |
关键词 | Graphene work function Cs-O adsorption Anderson– Newns model coverage calculation |
ISSN号 | 0361-5235 |
DOI | 10.1007/s11664-020-08574-0 |
通讯作者 | Jiang, Zhizhong(zhizhong.jiang@inest.cas.cn) |
英文摘要 | A modified Anderson-Newns (A-N) model for calculating the work function and the charge transfer of Cs-O-adsorbed graphene surface with the coverage of adsorbed particles is proposed. The calculation of the length of adsorption bond lambda is optimized. The work function and the amount of charge transfer for different coverage of Cs-O molecules are calculated, and the calculated results variations are in reasonable agreement with the experimental data. As coverage theta increases, the amount of charge transfer Z decreases and the work function phi first decreases to a certain value and then increases slightly. When theta = 0.8, the work function phi reaches a minimum value of 0.7. |
资助项目 | Youth Program of National Natural Science Foundation of China[21805283] ; Key Research Program of the Chinese Academy of Sciences[ZDRW-KT2019-1-0202] |
WOS关键词 | ALKALI-METAL OVERLAYERS ; CESIUM ; GRAPHITE ; ACTIVATION ; KINETICS ; SURFACE |
WOS研究方向 | Engineering ; Materials Science ; Physics |
语种 | 英语 |
出版者 | SPRINGER |
WOS记录号 | WOS:000588233000001 |
资助机构 | Youth Program of National Natural Science Foundation of China ; Key Research Program of the Chinese Academy of Sciences |
内容类型 | 期刊论文 |
源URL | [http://ir.hfcas.ac.cn:8080/handle/334002/105117] |
专题 | 中国科学院合肥物质科学研究院 |
通讯作者 | Jiang, Zhizhong |
作者单位 | 1.Univ Sci & Technol China, Hefei 230027, Anhui, Peoples R China 2.Chinese Acad Sci, Hefei Inst Phys Sci, Inst Nucl Energy Safety Technol, Key Lab Neutron & Radiat Safety, Hefei 230031, Anhui, Peoples R China |
推荐引用方式 GB/T 7714 | Li, Yukun,Xu, Gang,Hu, Huiqing,et al. Adsorption of Cs-O on Graphene: Modification of the Anderson-Newns Model for the Calculation of Work Function Variation[J]. JOURNAL OF ELECTRONIC MATERIALS,2020. |
APA | Li, Yukun,Xu, Gang,Hu, Huiqing,Cheng, Xiaoyu,&Jiang, Zhizhong.(2020).Adsorption of Cs-O on Graphene: Modification of the Anderson-Newns Model for the Calculation of Work Function Variation.JOURNAL OF ELECTRONIC MATERIALS. |
MLA | Li, Yukun,et al."Adsorption of Cs-O on Graphene: Modification of the Anderson-Newns Model for the Calculation of Work Function Variation".JOURNAL OF ELECTRONIC MATERIALS (2020). |
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