First principles study on electronic, optical and catalytic properties of designed Zr-doped structures based on Hf2CO2

Autor: Feng, Shiquan, Zhao, Jianling, Yang, Yang, Xie, Luogang, Li, Xiaodong, Cheng, Xuerui, Wang, Zheng, Liang, Yongfu
Zdroj: In Journal of Molecular Structure 15 July 2024 1308
Databáze: ScienceDirect