Lv4
700 积分 2024-09-10 加入
The adsorption of carbon and nitrogen oxides on the PuO2 {110} surface: A DFT + U study
4天前
已完结
Computer simulation of defect clusters in UO2 and their dependence on composition
13天前
已完结
Large-scale density functional theory simulations of defects and hydrogen incorporation in PuO2
13天前
已完结
Unveiling anionic migration mechanisms governed by mixed-anion chemistry in melilite oxyfluorides
17天前
已完结
Molecular reactions and oxidation corrosion on UN (001) surface under exposure to environment gases: A DFT study
20天前
已完结
First principles studies on the interaction of O2 with X@Al12 (X = Al−, P+, C, Si) clusters
21天前
已关闭
Effect of point defects on water adsorption on the ThO2{111} surface: A first-principles computational study
25天前
已完结
Neglected Biogeochemical Process for Ocean Health: Seagrass Detritus Simultaneously Enhances Phenolic Endocrine-Disrupting Chemical Capture and Organic Carbon Sequestration
1个月前
已完结
Atomistic investigation of uranium oxycarbide (UCO) phase stability at finite temperatures: DFT+U and AIMD+U approaches
1个月前
已完结
Applications of density functional theory to corrosion and corrosion prevention of metals: A review
1个月前
已完结
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