RESEARCH PAPER · Chemistry of Materials · 2025

Computational Screening and Experimental Validation of Promising Wadsley-Roth Niobates

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DFT reveals why Mo substitution enables multi-electron redox in Wadsley–Roth Mo x W 1− x Nb 12 O 33
Journal of Materials Chemistry A · 2026-01-01
Luke D. Salzer, Cami Christensen, Claire Y Gervais, Alexander G. Squires, Alexis G. Manche, Danielle R. Lustig, Amy L. Prieto, James Richmond Neilson, David O. Scanlon, Justin B. Sambur
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Structural Evolution and Chemical Incorporation Pathways in Wadsley-Roth Oxides
Inorganic Chemistry · 2026-10-10
R. Jackson Spurling, Marlena Alexander, Michael Richard Koehler, Bernadette R. Cladek, Claudia J. Rawn, Philip D. Rack, Katharine Lynn Page
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