x | Cation distribution | aexpt (Å) | acalc (Å) | Boverall (Å2) | R-factors (%) | |
Tetrahedral (A) site | Octahedral (B) site | |||||
0.0 | (Co0.11Fe0.89)A | [Co0.89Fe1.11]B | 8.3599(5) | 8.3638 | 0.70(4) | RBragg = 3.88 RF = 2.85 c2 = 2.26 |
0.2 | (Co0.05Fe0.95)A | [Ni0.2Co0.75Fe1.05]B | 8.3445(6) | 8.3482 | 0.75(4) | RBragg = 5.21 RF = 3.72 c2 = 2.91 |
0.4 | (Co0.03Fe0.97)A | [Ni0.4Co0.57Fe1.03]B | 8.3349(5) | 8.3388 | 0.76(4) | RBragg = 3.96 RF = 2.58 c2 = 2.89 |
0.6 | (Co0.02Fe0.98)A | [Ni0.6Co0.38Fe1.02]B | 8.3256(5) | 8.3251 | 0.59(4) | RBragg = 4.60 RF = 3.03 c2 = 2.43 |
0.8 | (Ni0.05Fe0.95)A | [Ni0.75Co0.2Fe1.05]B | 8.3173(5) | 8.3209 | 0.64(4) | RBragg = 3.69 RF = 2.97 c2 = 2.23 |
1.0 | (Ni0.37Fe0.63)A | [Ni0.63Fe1.37]B | 8.3075(5) | 8.3040 | 0.62(4) | RBragg = 3.86 RF = 3.08 c2 = 2.53 |