Interface Nucleus Templating of Modular Intermetallic Morphologies: Chemical Pressure Complementarity, Columnar Domains, and Complex Disorder in Y <sub>13</sub> Ag <sub>42.7</sub> Zn <sub>29.7</sub>

One element of the diversity of intermetallic phases is the formation of complex structures from the assembly of fragments of simpler structures. Recently, we devised the Interface Nuclear Approach as a model for understanding such modular arrangements, in which the intergrowth of different structures is driven by chemical pressure (CP) relief at shared motifs at the domain interfaces, referred to as interface nuclei. In this Article, we present the synthesis, crystal structure, and CP analysis of a new compound that expands on this theme, Y<sub>13</sub>Ag<sub>42.7</sub>Zn<sub>29.7</sub>. Its hexagonal structure contains interpenetrating domains based on the CaPd<sub>5+<i>x</i></sub> and EuMg<sub>5</sub> types. The CaPd<sub>5+<i>x</i></sub>-based regions are reminiscent of the lamellar intergrowth structures previously observed in the Y-Ag-Zn system. In Y<sub>13</sub>Ag<sub>42.7</sub>Zn<sub>29.7</sub>, however, the domains have a different morphology, forming columns that adopt a hexagonal rod-packing. The geometrical features of the remaining spaces are assigned, using the program <i>GrowDomain</i>, to the cores of trigonal units of the EuMg<sub>5</sub> type, while layers of disordered atoms occur at heights along <i>z</i> where the parent structures are mismatched. At the CaPd<sub>5+<i>x</i></sub>-type/EuMg<sub>5</sub>-type interfaces, simple interface nucleus motifs with strong CP-complementarity can be identified, while their distribution within the parent structures supports the notion of templated architectures in modular intermetallics.

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Journal
Inorganic Chemistry
Published
2025-10-25
DOI
https://doi.org/10.1021/acs.inorgchem.5c03538
Primary Topic
Rare-earth and actinide compounds
Type
article
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article

Interface Nucleus Templating of Modular Intermetallic Morphologies: Chemical Pressure Complementarity, Columnar Domains, and Complex Disorder in Y 13 Ag 42.7 Zn 29.7

Daniel C. Fredrickson, Rie Takagi
Inorganic Chemistry
Rare-earth and actinide compounds
article

Interface Nucleus Templating of Modular Intermetallic Morphologies: Chemical Pressure Complementarity, Columnar Domains, and Complex Disorder in Y 13 Ag 42.7 Zn 29.7

Daniel C. Fredrickson, Rie Takagi
article en

Abstract

One element of the diversity of intermetallic phases is the formation of complex structures from the assembly of fragments of simpler structures. Recently, we devised the Interface Nuclear Approach as a model for understanding such modular arrangements, in which the intergrowth of different structures is driven by chemical pressure (CP) relief at shared motifs at the domain interfaces, referred to as interface nuclei. In this Article, we present the synthesis, crystal structure, and CP analysis of a new compound that expands on this theme, Y<sub>13</sub>Ag<sub>42.7</sub>Zn<sub>29.7</sub>. Its hexagonal structure contains interpenetrating domains based on the CaPd<sub>5+<i>x</i></sub> and EuMg<sub>5</sub> types. The CaPd<sub>5+<i>x</i></sub>-based regions are reminiscent of the lamellar intergrowth structures previously observed in the Y-Ag-Zn system. In Y<sub>13</sub>Ag<sub>42.7</sub>Zn<sub>29.7</sub>, however, the domains have a different morphology, forming columns that adopt a hexagonal rod-packing. The geometrical features of the remaining spaces are assigned, using the program <i>GrowDomain</i>, to the cores of trigonal units of the EuMg<sub>5</sub> type, while layers of disordered atoms occur at heights along <i>z</i> where the parent structures are mismatched. At the CaPd<sub>5+<i>x</i></sub>-type/EuMg<sub>5</sub>-type interfaces, simple interface nucleus motifs with strong CP-complementarity can be identified, while their distribution within the parent structures supports the notion of templated architectures in modular intermetallics.

Inorganic ChemistryVol. 64(44)
University of Wisconsin–Madison (US)
Openalex Percentile: Top 81%
Rare-earth and actinide compounds
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