First-principles hybrid functional study of the electronic structure and charge carrier mobility in perovskite CH3NH3SnI3
We calculate the electronic properties and carrier mobility of perovskite CH3NH3SnI3 as a solar cell absorber by using the hybrid functional method. The calculated result shows that the electron and hole mobilities have anisotropies with a large magnitude of 1.4 × 104cm2·V-1·s-1 along the y directio...
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          | Published in | 中国物理B:英文版 no. 10; pp. 355 - 361 | 
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| Main Author | |
| Format | Journal Article | 
| Language | English | 
| Published | 
          
        01.10.2016
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| Online Access | Get full text | 
| ISSN | 1674-1056 2058-3834  | 
| DOI | 10.1088/1674-1056/25/10/107202 | 
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| Summary: | We calculate the electronic properties and carrier mobility of perovskite CH3NH3SnI3 as a solar cell absorber by using the hybrid functional method. The calculated result shows that the electron and hole mobilities have anisotropies with a large magnitude of 1.4 × 104cm2·V-1·s-1 along the y direction. In view of the huge difference between hole and electron mobilities, the perovskite CH3NH3 Sn I3can be considered as a p-type semiconductor. We also discover a relationship between the effective mass anisotropy and electronic occupation anisotropy. The above results can provide reliable guidance for its experimental applications in electronics and optoelectronics. | 
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| Bibliography: | Li-Juan Wu;Yu-Qing Zhao;Chang-Wen Chen;Lin-Zhi Wang;Biao Liu;Meng-Qiu Cai;School of Physics and Electronics Science, Hunan University;Yali Middle School 11-5639/O4  | 
| ISSN: | 1674-1056 2058-3834  | 
| DOI: | 10.1088/1674-1056/25/10/107202 |