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L. V. C. Assali

University of São Paulo (USP)

  • University of São Paulo (USP)

SCHOLARLY PAPERS

3

DOWNLOADS

102

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0

Scholarly Papers (3)

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1.

Rapid Screening Strategy for Aluminum-Ion Battery Cathode Materials Using Data-Driven Filtering and Ab Initio Calculations

Number of pages: 14 Posted: 15 May 2025
L. C. Maciel, O. M. Sousa, F. O. Carvalho, L. V. C. Assali, M. V. Lalic, C. Moyses Araujo, Olle Eriksson, H. M. Petrilli and A. B. Klautau
Federal University of Para, Federal University of Para, Universidade Federal de Sergipe, University of São Paulo (USP), Universidade Federal de Sergipe, Karlstad University, Uppsala University - Department of Physics and Astronomy, University of São Paulo (USP) and Federal University of Para
Downloads 48 (1,086,013)

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Aluminum-Ion Battery, cathodes, materials project, data filters, Density Functional Theory

2.

Unveiling the Mechanism of Jahn-Teller Distortion and Magnetic Suppression in LiNiO2 during Delithiation: Insights from Electron Redistribution

Number of pages: 17 Posted: 17 Sep 2025
O. M. Sousa, D. Nafday, F. O. Carvalho, L. V. C. Assali, M. V. Lalic, A. Delin, C. Moyses Araujo, Olle Eriksson, H. M. Petrilli and A. B. Klautau
Federal University of Para, affiliation not provided to SSRN, Universidade Federal de Sergipe, University of São Paulo (USP), Universidade Federal de Sergipe, affiliation not provided to SSRN, Karlstad University, Uppsala University - Department of Physics and Astronomy, University of São Paulo (USP) and Federal University of Para
Downloads 34 (1,263,436)

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Redox process, LiNiO2, electronic structure, electronic charge redistribution, density functional theory

3.

Pressure Effect on the Structural, Electronic, and Magnetic Properties of the Battery Cathode Material Limn2o4: An Ab-Initio Study

Number of pages: 18 Posted: 09 Dec 2022
O. M. Sousa, F. Sorgenfrei, L. V. C. Assali, M. V. Lalic, A. B. Klautau, Patrik Thunström, C. M. Araujo, Olle Eriksson and H. M. Petrilli
Federal University of Para, Uppsala University, University of São Paulo (USP), Universidade Federal de Sergipe, Federal University of Para, Uppsala University - Department of Physics and Astronomy, Karlstad University, Uppsala University - Department of Physics and Astronomy and University of São Paulo (USP)
Downloads 20 (1,448,301)

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Cathode materials, LiMn2O4 under pressure, electronic structure.