Figure 4
A plot of the best Rwp of all irreps against temperature for three different PDF peak shape functions used during refinement against ScF3 X-ray PDF data. The data points are made to differentiate between irrep labels: the marker designates the k point (a circle for M, a triangle for R, a star for X and a plus for Γ); the colour designates the number in the subscript (blue for 1, red for 2, green for 3, black for 4 and cyan for 5); and the linestyle designates the sign of the superscript (solid for +, dashed for −). |