Tb. Ballaran et al., HARD MODE INFRARED-SPECTROSCOPY OF CATION ORDERING AND SUBSTITUTION IN A CHAIN SILICATE, Phase transitions, 63(1-4), 1997, pp. 159-170
Infrared powder-absorption spectra of natural ordered (P2/n) and disor
dered (C2/c) as well as experimentally disordered pyroxenes lying in t
he binary join augite-jadeite were recorded at room temperature in the
frequency region 70-1400 cm(-1). Frequency shifts and linewidth varia
tions as a function of composition and degree of order were examined i
n particular detail over the spectral ranges 100-200 cm(-1) and 610-80
0 cm(-1). Phonon signals at low frequencies are very sensitive to both
changes in composition and degree of order, and are indicative of a n
on-ideal mixing behaviour for the C2/c solid solution, Phonons at high
frequencies depend on the average composition of the samples and not
on local configurational changes related to the order-disorder transit
ion, A linear correlation between the short-range order parameter obta
ined by IR analysis and the long-range order parameter obtained by str
uctural refinements of ?C-ray single crystal diffraction data was foun
d. Substantial line broadening in C2/c samples with intermediate compo
sitions is interpreted in terms of local structural heterogeneities.