Advances in the Parameter Space Concept towards Picometer Precise Crystal Structure Refinement—A Resolution Study

Advances in the Parameter Space Concept towards Picometer Precise Crystal Structure Refinement—A Resolution Study

The Parameter Space Concept (PSC) is an alternative approach to solving and refining (partial) crystal structures from very few pre-chosen X-ray or neutron diffraction amplitudes without the use of Fourier inversion. PSC interprets those amplitudes as piecewise analytic hyper-surfaces, so-called iso...

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Bibliographic Details
Main Authors: Matthias Zschornak, Christian Wagner, Melanie Nentwich, Muthu Vallinayagam, Karl F. Fischer
Format: Article
Language:English
Published: MDPI AG 2024-07-01
Series:Crystals
Subjects:
parameter space concept
high resolution
high quality
validation and reproducibility in structural science
X-ray diffraction
resonant contrast
Online Access:https://www.mdpi.com/2073-4352/14/8/684

Internet

https://www.mdpi.com/2073-4352/14/8/684

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