Theoretical Investigations of Structural Phase Transitions and Magnetic, Electronic and Thermal Properties of DyNi: Under High Pressures and Temperatures

Table 1

Lattice coordinates (𝑥, 𝑦, 𝑧) in FeB. CrB, CsCl, and NaCl phases of DyNi.

Atoms	Lattice coordinates
	𝑥	𝑦	𝑧
	FeB phase
Dy	0.179	0.250	0.132
Ni	0.035	0.250	0.609
	CrB phase
Dy	0.000	0.146	0.250
Ni	0.000	0.440	0.250
	CsCl/NaCl phases
Dy	0.000	0.000	0.000
Ni	0.500	0.500	0.500