Computational prediction of the electronic structure and optical properties of graphene-like β-CuN3

Xu Zhang, Xudong Zhao, Yu Jing, Dihua Wu, Zhen Zhou
2015 Physical Chemistry, Chemical Physics - PCCP  
Graphene-like β-CuN3 was investigated by first-principles computations, and its electronic structure and optical properties were disclosed in detail.
doi:10.1039/c5cp06208j pmid:26568356 fatcat:n6ny7wszp5hw3bxw357qg4ysa4