Ted Janssen, Gervais Chapuis, and Marc de Boissieu
- Published in print:
- 2018
- Published Online:
- August 2018
- ISBN:
- 9780198824442
- eISBN:
- 9780191863288
- Item type:
- chapter
- Publisher:
- Oxford University Press
- DOI:
- 10.1093/oso/9780198824442.003.0004
- Subject:
- Physics, Crystallography: Physics, Condensed Matter Physics / Materials
This chapter discusses the X-ray and neutron diffraction methods used to study the atomic structures of aperiodic crystals, addressing indexing diffraction patterns, superspace, ab initio methods, ...
More
This chapter discusses the X-ray and neutron diffraction methods used to study the atomic structures of aperiodic crystals, addressing indexing diffraction patterns, superspace, ab initio methods, the structure factor of incommensurate structures; and diffuse scattering. The structure solution methods based on the dual space refinements are described, as they are very often applied for the resolution of aperiodic crystal structures. Modulation functions which are used for the refinement of modulated structures and composite structures are presented and illustrated with examples of structure models covering a large spectrum of structures from organic to inorganic compounds, including metals, alloys, and minerals. For a better understanding of the concept of quasicrystalline structures, one-dimensional structure examples are presented first. Further examples of quasicrystals, including decagonal quasicrystals and icosahedral quasicrystals, are analysed in terms of increasing shells of a selected number of polyhedra. The notion of the approximant is compared with classical forms of structures.Less
This chapter discusses the X-ray and neutron diffraction methods used to study the atomic structures of aperiodic crystals, addressing indexing diffraction patterns, superspace, ab initio methods, the structure factor of incommensurate structures; and diffuse scattering. The structure solution methods based on the dual space refinements are described, as they are very often applied for the resolution of aperiodic crystal structures. Modulation functions which are used for the refinement of modulated structures and composite structures are presented and illustrated with examples of structure models covering a large spectrum of structures from organic to inorganic compounds, including metals, alloys, and minerals. For a better understanding of the concept of quasicrystalline structures, one-dimensional structure examples are presented first. Further examples of quasicrystals, including decagonal quasicrystals and icosahedral quasicrystals, are analysed in terms of increasing shells of a selected number of polyhedra. The notion of the approximant is compared with classical forms of structures.
Ted Janssen, Gervais Chapuis, and Marc de Boissieu
- Published in print:
- 2018
- Published Online:
- August 2018
- ISBN:
- 9780198824442
- eISBN:
- 9780191863288
- Item type:
- chapter
- Publisher:
- Oxford University Press
- DOI:
- 10.1093/oso/9780198824442.003.0007
- Subject:
- Physics, Crystallography: Physics, Condensed Matter Physics / Materials
The law of rational indices to describe crystal faces was one of the most fundamental law of crystallography and is strongly linked to the three-dimensional periodicity of solids. This chapter ...
More
The law of rational indices to describe crystal faces was one of the most fundamental law of crystallography and is strongly linked to the three-dimensional periodicity of solids. This chapter describes how this fundamental law has to be revised and generalized in order to include the structures of aperiodic crystals. The generalization consists in using for each face a number of integers, with the number corresponding to the rank of the structure, that is, the number of integer indices necessary to characterize each of the diffracted intensities generated by the aperiodic system. A series of examples including incommensurate multiferroics, icosahedral crystals, and decagonal quaiscrystals illustrates this topic. Aperiodicity is also encountered in surfaces where the same generalization can be applied. The chapter discusses aperiodic crystal morphology, including icosahedral quasicrystal morphology, decagonal quasicrystal morphology, and aperiodic crystal surfaces; magnetic quasiperiodic systems; aperiodic photonic crystals; mesoscopic quasicrystals, and the mineral calaverite.Less
The law of rational indices to describe crystal faces was one of the most fundamental law of crystallography and is strongly linked to the three-dimensional periodicity of solids. This chapter describes how this fundamental law has to be revised and generalized in order to include the structures of aperiodic crystals. The generalization consists in using for each face a number of integers, with the number corresponding to the rank of the structure, that is, the number of integer indices necessary to characterize each of the diffracted intensities generated by the aperiodic system. A series of examples including incommensurate multiferroics, icosahedral crystals, and decagonal quaiscrystals illustrates this topic. Aperiodicity is also encountered in surfaces where the same generalization can be applied. The chapter discusses aperiodic crystal morphology, including icosahedral quasicrystal morphology, decagonal quasicrystal morphology, and aperiodic crystal surfaces; magnetic quasiperiodic systems; aperiodic photonic crystals; mesoscopic quasicrystals, and the mineral calaverite.
