Ab initio investigation of ZnV2O4, ZnV2S4, and ZnV2Se4 as cathode materials for aqueous zinc-ion batteries (2025)
- Authors:
- USP affiliated authors: PETRILLI, HELENA MARIA - IF ; ASSALI, LUCY VITORIA CREDIDIO - IF
- Unidade: IF
- Assunto: FÍSICA DA MATÉRIA CONDENSADA
- Keywords: CATHODE MATERIALS; ZnV2O4; ZnV2Se4; DENSITY FUNCTIONAL THEORY; ZINC-ION BATTERIES
- Agências de fomento:
- Language: Inglês
- Imprenta:
- Source:
- Título: Acta Materialia
- Volume/Número/Paginação/Ano: Volume 282, 1 January 2025, 120468
-
ABNT
SOUSA, O M et al. Ab initio investigation of ZnV2O4, ZnV2S4, and ZnV2Se4 as cathode materials for aqueous zinc-ion batteries. Acta Materialia, 2025Tradução . . Disponível em: https://doi.org/10.1016/j.actamat.2024.120468. Acesso em: 09 abr. 2026. -
APA
Sousa, O. M., Sorgenfrei, F., Carvalho, F. O., Assali, L. V. C., Lalic, M. V., Thunström, P., et al. (2025). Ab initio investigation of ZnV2O4, ZnV2S4, and ZnV2Se4 as cathode materials for aqueous zinc-ion batteries. Acta Materialia. Recuperado de https://doi.org/10.1016/j.actamat.2024.120468 -
NLM
Sousa OM, Sorgenfrei F, Carvalho FO, Assali LVC, Lalic MV, Thunström P, Araujo CM, Eriksson O, Petrilli HM, Klautau AB. Ab initio investigation of ZnV2O4, ZnV2S4, and ZnV2Se4 as cathode materials for aqueous zinc-ion batteries [Internet]. Acta Materialia. 2025 ;[citado 2026 abr. 09 ] Available from: https://doi.org/10.1016/j.actamat.2024.120468 -
Vancouver
Sousa OM, Sorgenfrei F, Carvalho FO, Assali LVC, Lalic MV, Thunström P, Araujo CM, Eriksson O, Petrilli HM, Klautau AB. Ab initio investigation of ZnV2O4, ZnV2S4, and ZnV2Se4 as cathode materials for aqueous zinc-ion batteries [Internet]. Acta Materialia. 2025 ;[citado 2026 abr. 09 ] Available from: https://doi.org/10.1016/j.actamat.2024.120468 - Illusory nickel and oxygen oxidation driven by electron redistribution in 'e IND.g' and 't IND.2g' orbitals in LiNi'O IND.2' cathode material
- Accelerating the design of cathode materials for rechargeable zinc-ion batteries using data filters and Ab initio calculations
- Ab initio investigation of cathode materials for rechargeable zinc ion batteries
- Charging behavior of ZnMn2O4 and LiMn2O4 in a zinc- and lithium-ion battery: an ab initio study
- Site localization of Cd impurities in sapphire
- Ge-based clinopyroxene series: First principles and experimental local probe study
- Study of the charging behavior of Zn'V IND.2''O IND.4', Zn'V IND.2''S IND.4', and Zn'V IND.2''Se IND.4' in a zinc ion battery via DFT
- A first-principles study of the structural, electronic, magnetic, spectroscopic, and electrochemical properties of Zn'Mn IND.2''O IND.4' and Li'Mn IND.2''O IND.4' in a zinc- and lithium-ion battery
- Hyperfine interactions in silicon quantum dots
- Ab-initio study of the properties of LiMn2O4 under ambient conditions and at high pressures
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