A systematic ab initio study of vacancy formation energy, diffusivity, and ionic conductivity of Ln2NiO4+δ (Ln=La, Nd, Pr)

Yang, Songge; Liu, Guangchen; Lee, Yueh-Lin; Bassat, Jean-Marc; Gamon, Jacinthe; Villesuzanne, Antoine; Pietras, John; Zhou, Xiao-Dong; Zhong, Yu

doi:10.1016/j.jpowsour.2023.233200

Title: A systematic ab initio study of vacancy formation energy, diffusivity, and ionic conductivity of Ln2NiO4+δ (Ln=La, Nd, Pr)

Journal Article · 01 August 2023 · Journal of Power Sources

DOI: https://doi.org/10.1016/j.jpowsour.2023.233200 · OSTI ID:1975303

;

; Lee, Yueh-Lin; Bassat, Jean-Marc; Gamon, Jacinthe; Villesuzanne, Antoine; Pietras, John; Zhou, Xiao-Dong;

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Sponsoring Organization:: USDOE

Grant/Contract Number:: FE0031972

OSTI ID:: 1975303

Journal Information:: Journal of Power Sources, Journal Name: Journal of Power Sources Journal Issue: C Vol. 576; ISSN 0378-7753

Publisher:: ElsevierCopyright Statement

Country of Publication:: Netherlands

Language:: English

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