High-pressure structural behaviour of heulandite

The structural evolution up to 5 GPa of a natural heulandite was studied using in situ single-crystal X-ray diffraction data from a diamond-anvil cell (DAC) with glycerol as the pressure transmitting medium. Linear regressions yielded mean axial compressibilities for a, b and c axes of beta (sub a) = 1.02(1).10 (super -2) , beta (sub b) = 8.1(6).10 (super -3) , beta (sub c) = 7.6(2).10 (super -3) GPa (super -1) . The largest strain vector (beta (sub 1) = 1.16 10 (super -2) GPa (super -1) ) lies approximately on the diagonal of the system of channels along [100] and [001]. V (sub 0) , K (sub 0) , and K' (sub 0) refined with a third-order Birch-Murnaghan equation are: V (sub 0) = 2121(2) Aa (super 3) , K (sub 0) = 26.4(1.0) GPa, K' (sub 0) = 4.9(8). If fitted with second-order Birch-Murnaghan equation of state, fixing K' (sub 0) = 4, K (sub 0) becomes 27.5(2) GPa. The bulk heulandite structure compression was the result of the "soft" behaviour of the channels (K = 10-19 GPa) and the more rigid behaviour of the tetrahedral framework (K congruent to 60 GPa), which underwent tilting of the fundamental polyhedral unit (FPU) chains. The T5-T5-T5 angles, between the FPUs, decreased from 162.4 degrees at 0.0001 GPa to 156.2 degrees at 3.4 GPa. The position of extra-framework cations and water molecules was almost maintained within the investigated pressure range. Up to 3.7 GPa no phase transition was observed. Amorphization was clearly observed at pressure above 4 GPa. The transition to the amorphous phase was still reversible up to 5 GPa.