The charge regulation of electronic structure and optical properties of graphitic carbon nitride under strain

• DOI: 10.1039/c9ra00396g
• Publication Date: 2019-03-06T12:09:59Z
• Authors: Hengshuai Li; Haiquan Hu; Chenglin Bai; Chunjiang Bao; Feng Guo; Zhenbao Feng; Yongjun Liu
• Keywords: Graphitic carbon nitride; Strain (injury); Carbon nitride; Carbon fibers

The electronic structure of the graphitic carbon nitride (g-C₆N₆) under strain was obtained using hybrid density functional HSE06 with a larger computational workload.