ChemInform Abstract: Density Functional Theory Calculations of UO2 Oxidation: Evolution of UO2‐x,U4O9‐y,U3O7, and U3O8.期刊界 All Journals 搜尽天下杂志传播学术成果专业期刊搜索期刊信息化学术搜索

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ChemInform Abstract: Density Functional Theory Calculations of UO2 Oxidation: Evolution of UO2‐x,U4O9‐y,U3O7, and U3O8.

Authors:	D A Andersson G Baldinozzi L Desgranges D R Conradson S D Conradson

Abstract:	DFT calculations of UO₂ oxidation indicate stable compounds U₄O_8.889, U₃O₇, and U₃O_7.333, which are based on ordering of split quad‐interstitial clusters.

Keywords:	theory of the condensed state uranium U oxygen O