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Halogen in materials design: Chloroammonium lead triiodide perovskite (ClNH3PbI3) a dynamical bandgap semiconductor in 3D for photovoltaics

Pradeep R. Varadwaj, Arpita Varadwaj, Helder Marques, Koichi Yamashita. Halogen in materials design: Chloroammonium lead triiodide perovskite (ClNH3PbI3) a dynamical bandgap semiconductor in 3D for photovoltaics. Journal of Computational Chemistry, 39(23):1902-1912, 2018. [doi]

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