中国物理B ›› 2009, Vol. 18 ›› Issue (5): 1991-1995.doi: 10.1088/1674-1056/18/5/043
陈波1, 麻焕锋2, 黄整2, 强伟荣2, 潘敏2
Ma Huan-Feng(麻焕锋)a), Huang Zheng(黄整)a)† , Chen Bo(陈波)b), Qiang Wei-Rong(强伟荣)a), and Pan Min(潘敏)a)
摘要: Based on density functional theory, using the scheme of the linearized augmented plane wave and the improved local orbital (APW+lo), this paper analyses and calculates the lattice parameters, formation energy and magnetism of the rare-earth permanent magnetic materials YFe12-xCrx (x=0~ 5). The stabilization effect and the possible positions of the substituted atom Cr are analysed. Magnetic moments for the system and the atoms are obtained.
中图分类号: (Alloys )