Crystal structure refinement and Mössbauer spectroscopy of an ordered, triclinic clinochlore
The crystal structure of a natural, ordered IIb-4 triclinic clinochlore has been refined in space group C 1¯ from 4282 unique X-ray intensity measurements of which 3833 are greater than 3 times the statistical counting error (3σ). Unit cell parameters are a = 5.3262(6) Å; b = 9.226(1) Å; c = 14.334(3) Å; α = 90.56(2)°; β = 97.47(2)°; and γ = 89.979(9)°, which represents the greatest deviation from monoclinic symmetry yet recorded for a triclinic chlorite. The final weighted R is 0.059 for reflections with I > 3σ and 0.064 for all reflections. The chemical formula is (Mg 0.966 Fe 0.034 ) M1 (Mg 0.962 Fe 0.038 ) M2 2 (Si 2.96 Al 1.04 )O 10 (OH) 2 (Mg 0.996 Fe 0.004 ) M3 2 (Al 0.841 Fe III 0.102 Cr 0.004 Ti 0.004 ) M4 (OH) 6 , which is consistent with electron microprobe (EMP), wet chemical analyses, Mössbauer spectroscopy and X-ray structure refinement. The high degree of ordering of the divalent versus trivalent octahedral cations in the interlayer is noteworthy, with Fe III and Al in M4 and virtually no Fe in M3. In the 2:1 layer, M1 and M2 each contain similar amounts of Fe. The 2 tetrahedral sites have nearly identical mean oxygen distances and volumes, and thus show no evidence of long-range cation ordering.