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Abstract
The development of alternative energy sources is crucial for reducing reliance on fossil fuels, particularly for mobile applications such as personal electronics and transportation. This necessitates the advancement of battery materials based on abundant and inexpensive constituent elements. To achieve this requires investigating materials in a broader compositional and structural design space. Early transition metal oxides, including the intercalation electrode α − V2O5, however, the performance of V2O5 is hindered by phase transformations during battery cycling that lead to capacity fade and short device lifetimes. This study investigates the modification of V2O5 through Mo substitution in a series of the form V 2 − x MoxO5 for x = 0.05, 0.1, 0.2, 0.4, 0.6, and 0.8. X-ray diffraction data reveal progressive structural changes with increasing Mo content, which in turn change the progression of phase transformations during the first discharge. The different product also results in different cycling profile shapes that indicate differences in the charge storage mechanism as a function of Mo content. As a result, samples with higher Mo-substitution, especially V1.2Mo0.8O5, have narrower hysteresis, higher capacity, and improved capacity retention. While there is a limited solubility of Mo in the V2O5 structure, with secondary phases and defects at many compositions, we show that Mo substitution alters the cycling behavior of V2O5 to deep discharge, which can inform the design of intercalation materials for energy storage applications.
Document Type
Article
Publication Date
4-1-2025
Digital Object Identifier (DOI)
10.1088/2515-7639/adc83e
Archival?
Archival
Repository Citation
Parui, Kausturi; Gardner, Bonnie G.; Pitton, Kathryn A.; Caracuel, Noah G.; Vidal-Torres, Emily; Gandhi, Shornam; Guiton, Beth S.; Nino, Juan C.; and Butala, Megan M., "Mo-substitution in V2O5 tunes the structure towards three-dimensional connectivity and improves Li-ion battery cycling" (2025). Chemistry Faculty Publications. 249.
https://uknowledge.uky.edu/chemistry_facpub/249

Notes/Citation Information
Publisher Copyright: © 2025 The Author(s). Published by IOP Publishing Ltd.