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Structural and electronic properties of hybrid perovskites for high-efficiency thin-film photovoltaics from first-principles

โœ Scribed by Brivio, Federico; Walker, Alison B.; Walsh, Aron

Book ID
121471192
Publisher
American Institute of Physics
Year
2013
Tongue
English
Weight
401 KB
Volume
1
Category
Article
ISSN
2166-532X

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The structural, electronic and thermodynamic properties of cubic Zn 3 N 2 under hydrostatic pressure up to 80 GPa are investigated using the local density approximation method with pseudopotentials of the ab initio norm-conserving full separable Troullier-Martin scheme in the frame of density functi