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Atomic‐scale oxidation mechanism of high‐entropy carbides via density functional theory and ab initio molecular dynamics.

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Title: Atomic‐scale oxidation mechanism of high‐entropy carbides via density functional theory and ab initio molecular dynamics.
Authors: Bai, Yang1, Liang, Yuxin1, Bi, Juan1, Cui, Baoning1, Lu, Zhaopeng1, Wang, Huangxuan1, You, Xixi1, Li, Bangsheng1,2,3, libshit@126.com
Source: Journal of the American Ceramic Society; Jun2025, Vol. 108 Issue 6, p1-12, 12p
Database: Applied Science & Technology Source
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Header DbId: aci
DbLabel: Applied Science & Technology Source
An: 184273649
AccessLevel: 2
PubType: Academic Journal
PubTypeId: academicJournal
PreciseRelevancyScore: 0
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  Data: Atomic‐scale oxidation mechanism of high‐entropy carbides via density functional theory and ab initio molecular dynamics.
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PLink https://search.ebscohost.com/login.aspx?direct=true&site=eds-live&db=aci&AN=184273649
RecordInfo BibRecord:
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    Identifiers:
      – Type: doi
        Value: 10.1111/jace.20448
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      – Code: eng
        Text: English
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        PageCount: 12
        StartPage: 1
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      – TitleFull: Atomic‐scale oxidation mechanism of high‐entropy carbides via density functional theory and ab initio molecular dynamics.
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            NameFull: Bai, Yang
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            NameFull: Liang, Yuxin
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            NameFull: Bi, Juan
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            NameFull: Lu, Zhaopeng
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            NameFull: Wang, Huangxuan
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            NameFull: You, Xixi
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            – D: 01
              M: 06
              Text: Jun2025
              Type: published
              Y: 2025
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              Value: 108
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              Value: 6
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            – TitleFull: Journal of the American Ceramic Society
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