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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...

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Detalhes bibliográficos
Publicado no:Nanoscale Res Lett
Main Authors: Liu, Zhao, Zhang, Ting, Wang, Yafei, Wang, Chenyun, Zhang, Peng, Sarvari, Hojjatollah, Chen, Zhi, Li, Shibin
Formato: Artigo
Idioma:Inglês
Publicado em: Springer US 2017
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC5371577/
https://ncbi.nlm.nih.gov/pubmed/28359143
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/s11671-017-2015-y
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