Phase Stability and Site Preference of Tb-Fe-Co-V Compounds

Table 1

Final crystal lattice constants of Tb₃Fe₂₉ corresponding to random initial structures.

Initial state		Final state
𝑎, 𝑏, 𝑐 (Å)	𝛼, 𝛽, 𝛾 (deg)	𝑎, 𝑏, 𝑐 (Å)	𝛼, 𝛽, 𝛾 (deg)
10, 8, 9	90, 95, 90	10.525, 8.433, 9.696	90, 96.91, 90
11, 10, 10	90, 100, 90	10.525, 8.433, 9.696	90, 96.91, 90
10, 10, 10	90, 90, 90	10.525, 8.433, 9.696	90, 96.91, 90
13, 10, 10	90, 95, 90	10.525, 8.433, 9.696	90, 96.91, 90
12, 12, 12	90, 90, 90	10.525, 8.433, 9.696	90, 96.91, 90
10, 10, 10	85, 90, 88	10.525, 8.433, 9.696	90, 96.91, 90
8, 8, 8	90, 90, 90	10.525, 8.433, 9.696	90, 96.91, 90