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cond-mat.mtrl-sci2026
X-ray Thermal diffuse scattering from real-space displacement correlations
Benjamin Fahl, Jonathan Bulled, Artem Korshunov +3
We introduce a method for calculating X-ray thermal diffuse scattering based on the three-dimensional difference pair distribution function (3D-dPDF). Within the harmonic approxima…
cond-mat.mtrl-sci2024
Negative thermal expansion in transition-metal dicyanides: the hidden role of the underlying diamondoid framework
Quentin Guéroult, Jonathan Bulled, Henry Patteson +5
The transition-metal dicyanides M(CN) (M = Zn, Cd) are amongst the most important negative thermal expansion (NTE) materials known, favoured for the magnitude, isotropy, and th…