Tuning the Hydrogenation Properties of Zr2Fe Alloy via Transition Metal (Mn, Co, Ni, Cu) Doping: A First-Principles Study
LI Zilu, QIN Qin, YE Rongxing, FENG Xingwen, LI Peilong, LI Fei, TIAN Xiaofeng, SONG Jiangfeng, ZHOU Linsen
Chem. J. Chinese Universities . 0, (): 20260152 .  DOI: 10.7503/cjcu20260152