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Figure 2
Errors resulting from linear interpolation between the parameterized values of [\beta f^{\prime}\exp({-Bs^{2})}], compared with those calculated from the integral of equation (2)[link] for carbon (Z = 6), gallium (Z = 31) and lead (Z = 82). The range of scattering vector [s = sin(θ)/λ = g/2] is 0 < s < 3 and isotropic Debye–Waller factor is 0 < Biso < 4. Values are given as fractions of the maximum value of [\beta f^{\prime}\exp({-Bs^{2})}] over the mapped range. In the blank region, f′ = 0.

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ISSN: 2053-2733
Volume 80| Part 2| March 2024| Pages 146-150
https://doi.org/10.1107/S2053273323010963
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