Table 2. Summary of magnetic and spectral parameters for 1–3 a .
1 | 2 | 3 | |
g x b | 2.00(1) | 2.00(3) | 2.00(1) |
g y b | 2.02(1) | 2.07(1) | 2.04(1) |
g z b | 2.10(4) | 2.10(3) | 2.08(3) |
D b (cm–1) | 5.21(3) | 5.35(5) | 5.61(9) |
E b (cm–1) | 0.59(2) | 0.60(2) | 0.59(2) |
E/D b | 0.11 | 0.11 | 0.10 |
g iso c | 2.04 | 2.07 | 2.11 |
g iso d | 2.04(1) | 2.08(2) | 2.07(1) |
D d (cm–1) | 5.6(1) | 6.5(3) | 5.5(2) |
|E| d (cm–1) | 0.5(3) | 0.7(2) | 0.7(1) |
δ (mm s–1) | 0.680(1) | 0.663(1) | 0.677(1) |
ΔEQ (mm s–1) | 4.326(2) | 4.283(1) | 4.330(1) |
aReported errors in EPR parameters were estimated by variance in quality of the simulation of the 406.4 GHz spectrum and the resonant field vs. frequency plot as a function of parameter variance.
bDetermined by EPR.
cObtained from value of χMT at 300 K.
dDetermined by fits of variable-temperature, variable-field χMT data. Errors determined by averaging over the fits to data sets collected at 0.1, 0.5, and 1 T dc applied fields.