Pathway to oxide photovoltaics via band-structure engineering of SnO

Autor: Haowei Peng, Andre Bikowski, Andriy Zakutayev, Stephan Lany
Jazyk: angličtina
Rok vydání: 2016
Předmět:
Zdroj: APL Materials, Vol 4, Iss 10, Pp 106103-106103-9 (2016)
Druh dokumentu: article
ISSN: 2166-532X
DOI: 10.1063/1.4963661
Popis: All-oxide photovoltaics could open rapidly scalable manufacturing routes, if only oxide materials with suitable electronic and optical properties were developed. SnO has exceptional doping and transport properties among oxides, but suffers from a strongly indirect band gap. Here, we address this shortcoming by band-structure engineering through isovalent but heterostructural alloying with divalent cations (Mg, Ca, Sr, and Zn). Using first-principles calculations, we show that suitable band gaps and optical properties close to that of direct semiconductors are achievable, while the comparatively small effective masses are preserved in the alloys. Initial thin film synthesis and characterization support the feasibility of the approach.
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