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Updated: Apr 26, 2026

Methods of Ex Situ and In Situ Investigations of Structural Transformations: The Case of Crystallization of Metallic Glasses
Published on: June 7, 2018
NMR crystallography: Applications to inorganic materials
1Tectospin, Institut Lavoisier de Versailles, UMR CNRS 8180, Université de Versailles St-Quentin en Yvelines, 45, avenue des Etats-Unis, 78035 Versailles cedex, France.
Nuclear Magnetic Resonance (NMR) crystallography advances enable detailed analysis of inorganic solids. This technique complements diffraction methods for crystal structure determination and reveals local atomic order not captured by traditional crystallography.
Area of Science:
- Solid-state chemistry
- Crystallography
- Materials science
Background:
- Diffraction methods are standard for crystal structure determination.
- Limitations exist in diffraction for analyzing local order and non-periodic structures.
- Solid-state Nuclear Magnetic Resonance (NMR) spectroscopy offers complementary structural information.
Purpose of the Study:
- To present current developments in NMR crystallography.
- To showcase applications of NMR crystallography in diamagnetic inorganic solids.
- To illustrate the synergistic use of NMR and diffraction data for comprehensive structural analysis.
Main Methods:
- Combining solid-state NMR data with diffraction data (powder and single-crystal).
- Utilizing NMR crystallography for space group selection, structure determination, refinement, and validation.
- Applying NMR spectroscopy to investigate local order and disorder in materials.
Main Results:
- Demonstrated successful integration of NMR and diffraction data for crystal structure determination.
- Showcased NMR crystallography's capability to provide insights beyond periodic structures.
- Illustrated the analysis of local structural features, including order/disorder phenomena.
Conclusions:
- NMR crystallography is a powerful tool for inorganic solid structural analysis.
- The combination of NMR and diffraction offers a more complete structural description.
- NMR crystallography extends structural characterization to non-periodic and local atomic arrangements.
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