The role of CO on initial oxidation behavior of α-U(001) surface: A first principles study
A first-principles approach based on density-functional theory has been used to investigate the corrosion resistance of alpha-U in the CO environment. Calculations show that O2 molecules spontaneously dissociate on the uranium surface, and the two O atoms formed by dissociation tend to adsorb on the...
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Main Authors: | Longxian Li, Min Zhu, Yan Li, Yanru Ren, Longfei Pu, Chengxuan Peng |
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Format: | Article |
Language: | English |
Published: |
Elsevier
2025-01-01
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Series: | Nuclear Engineering and Technology |
Subjects: | |
Online Access: | http://www.sciencedirect.com/science/article/pii/S173857332400367X |
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