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 (2024)
- Authors:
- USP affiliated authors: ASSALI, LUCY VITORIA CREDIDIO - IF ; PETRILLI, HELENA MARIA - IF
- Unidade: IF
- Subjects: PROPRIEDADES DOS MATERIAIS; LÍTIO; BATERIAS ELÉTRICAS
- Language: Inglês
- Imprenta:
- Publisher: Sociedade Brasileira de Física
- Publisher place: São Paulo
- Date published: 2024
- Source:
- Título: Program
- Conference titles: Encontro de Outono da Sociedade Brasileira de Física - EOSBF
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ABNT
SOUSA, O. M. et al. 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. 2024, Anais.. São Paulo: Sociedade Brasileira de Física, 2024. . Acesso em: 11 mar. 2026. -
APA
Sousa, O. M., Assali, L. V. C., Lalic, M. V., Araujo, C. M., Eriksson, O., Petrilli, H. M., & Klautau, A. B. (2024). 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. In Program. São Paulo: Sociedade Brasileira de Física. -
NLM
Sousa OM, Assali LVC, Lalic MV, Araujo CM, Eriksson O, Petrilli HM, Klautau AB. 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. Program. 2024 ;[citado 2026 mar. 11 ] -
Vancouver
Sousa OM, Assali LVC, Lalic MV, Araujo CM, Eriksson O, Petrilli HM, Klautau AB. 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. Program. 2024 ;[citado 2026 mar. 11 ] - 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
- Ge-based clinopyroxene series: First principles and experimental local probe study
- 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
- Hyperfine interactions in silicon quantum dots
- Site localization of Cd impurities in sapphire
- Ab initio investigation of ZnV2O4, ZnV2S4, and ZnV2Se4 as cathode materials for aqueous zinc-ion batteries
- 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
- Ab-initio study of the properties of LiMn2O4 under ambient conditions and at high pressures
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