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Electronic Properties of a New All-Inorganic Perovskite TlPbI(3) Simulated by the First Principles
All-inorganic perovskites have been recognized as promising photovoltaic materials. We simulated the perovskite material of TlPbI(3) using ab initio electronic structure calculations. The band gap of 1.33 eV is extremely close to the theoretical optimum value. Compared TlPbI(3) with CsPbI(3), the to...
Autores principales: | , , , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Springer US
2017
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5371577/ https://www.ncbi.nlm.nih.gov/pubmed/28359143 http://dx.doi.org/10.1186/s11671-017-2015-y |