Published online by Cambridge University Press: 10 February 2011
Both neutron-powder-diffraction and neutron-vibrational-spectroscopy studies have been undertaken to characterize the structures and vibrational dynamics of a variety of bulk hcp rareearth trihydrides RH3 (where R = Y, Th, Dy, Ho, Er, and Lu). The results are consistent with P3c1 as the prevalent structural symmetry for all trihydrides investigated except LuH3. Corresponding results for LuH3 are suggestive of an atypical arrangement of H atoms. Preliminary analyses of LuD3 diffraction patterns indicate that the main peaks can be satisfactorily modeled using P63/mmc symmetry with a reduced unit cell, although numerous minor diffraction features and a relatively unusual vibrational spectrum hint at either a more complex structure or an unknown secondary phase. The deviations from P3c1 symmetry are likely a consequence of the relatively smaller metal-hydrogen bond distances for LuH3.