TY - JOUR
T1 - Towards a unified description of the AMOB2O5 (a = K, Rb, Cs, TI; M = Nb, Ta) family of compounds
AU - Schmid, Siegbert
AU - Withers, Ray L.
AU - Corker, Deborah
AU - Baules, Pierre
PY - 2000/8
Y1 - 2000/8
N2 - Single-crystal X-ray diffraction data (Mo Kα radiation) are used to re-refine the structure of RbNbOB2O5, rubidium niobium oxo pyroborate. The structure is refined as an incommensurate modulated structure with superspace group symmetry Pmn21(0,0.4,0)s and lattice parameters a = 7.406 (2), b = 3.939 (2) and c = 9.475 (2) A. Refinement on 3242 unique reflections converged to R = 0.031, while a previous conventional superstructure refinement led to R = 0.090. This lowering of the R factor goes hand-in-hand with a substantial reduction in the number of refined parameters. The refinement strongly suggests that the structure is effectively incommensurately modulated, despite an apparently rational magnitude of the primary modulation wave-vector and overlap of satellite reflections.
AB - Single-crystal X-ray diffraction data (Mo Kα radiation) are used to re-refine the structure of RbNbOB2O5, rubidium niobium oxo pyroborate. The structure is refined as an incommensurate modulated structure with superspace group symmetry Pmn21(0,0.4,0)s and lattice parameters a = 7.406 (2), b = 3.939 (2) and c = 9.475 (2) A. Refinement on 3242 unique reflections converged to R = 0.031, while a previous conventional superstructure refinement led to R = 0.090. This lowering of the R factor goes hand-in-hand with a substantial reduction in the number of refined parameters. The refinement strongly suggests that the structure is effectively incommensurately modulated, despite an apparently rational magnitude of the primary modulation wave-vector and overlap of satellite reflections.
UR - http://www.scopus.com/inward/record.url?scp=0040793387&partnerID=8YFLogxK
U2 - 10.1107/S0108768100002871
DO - 10.1107/S0108768100002871
M3 - Article
SN - 0108-7681
VL - 56
SP - 558
EP - 564
JO - Acta Crystallographica Section B: Structural Science
JF - Acta Crystallographica Section B: Structural Science
IS - 4
ER -