Extracting structural motifs from pair distribution function data of nanostructures using explainable machine learning
Abstract Characterization of material structure with X-ray or neutron scattering using e.g. Pair Distribution Function (PDF) analysis most often rely on refining a structure model against an experimental dataset. However, identifying a suitable model is often a bottleneck. Recently, automated approa...
Main Authors: | Andy S. Anker, Emil T. S. Kjær, Mikkel Juelsholt, Troels Lindahl Christiansen, Susanne Linn Skjærvø, Mads Ry Vogel Jørgensen, Innokenty Kantor, Daniel Risskov Sørensen, Simon J. L. Billinge, Raghavendra Selvan, Kirsten M. Ø. Jensen |
---|---|
Format: | Article |
Language: | English |
Published: |
Nature Portfolio
2022-10-01
|
Series: | npj Computational Materials |
Online Access: | https://doi.org/10.1038/s41524-022-00896-3 |
Similar Items
-
Beam damage in operando X-ray diffraction studies of Li-ion batteries
by: Christian Kolle Christensen, et al.
Published: (2023-05-01) -
Effect of Chain Length on Swelling Transitions of Brodie Graphite Oxide in Liquid 1‐Alcohols
by: Artem Iakunkov, et al.
Published: (2024-01-01) -
Flexible design in the stomatopod dactyl club
by: Christensen, Thorbjørn Erik Køppen, et al.
Published: (2023) -
Flexible design in the stomatopod dactyl club
by: Thorbjørn Erik Køppen Christensen, et al.
Published: (2023-05-01) -
xrdPlanner: exploring area detector geometries for powder diffraction and total scattering experiments
by: Lennard Krause, et al.
Published: (2024-03-01)