Journal Article FZJ-2026-02155

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Changing Polyhedral Connectivity through Sulfide Introduction in an Ionically Conducting Na–Ta–Cl–S Mixed Anion System

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2026
ACS Publications Washington, DC

ACS materials letters 8(4), 1163-1169 () [10.1021/acsmaterialslett.5c01628]

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Abstract: Mixed-anion strategies have proven effective in designing materials with diverse functionalities, particularly for enhancing the ionic conductivity in sodium halides. While prior efforts have largely focused on incorporating oxide anions into halide frameworks, the exploration of other anions, such as sulfides, has recently begun. According to Pauling’s third rule, highly charged cations disfavor ordered edge- or face-sharing polyhedra, making mixed-anion substitution an effective route to promote the structural disorder needed for fast $Na^+$ transport. Here, we contribute to these emerging efforts by investigating sulfide incorporation in amorphous $Ta^{5+}$ containing Na–halide frameworks. Furthermore, we reveal the formation of an amorphous matrix with structural motifs distinct from those of oxychlorides. These unique features facilitate $Na^+$ transport, achieving room-temperature ionic conductivity of 3.8 $mS·cm^{–1}$.

Classification:

Contributing Institute(s):
  1. Helmholtz-Institut Münster Ionenleiter für Energiespeicher (IMD-4)
Research Program(s):
  1. 1221 - Fundamentals and Materials (POF4-122) (POF4-122)

Appears in the scientific report 2026
Database coverage:
Medline ; Embargoed OpenAccess ; Clarivate Analytics Master Journal List ; Current Contents - Engineering, Computing and Technology ; Current Contents - Physical, Chemical and Earth Sciences ; Essential Science Indicators ; IF >= 10 ; JCR ; SCOPUS ; Science Citation Index Expanded ; Web of Science Core Collection
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Open Access

 Datensatz erzeugt am 2026-04-01, letzte Änderung am 2026-05-11


Published on 2026-02-27. Available in OpenAccess from 2027-02-27.:
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