【摘 要】
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Adsorption of atomic carbon on δ-Pu(111)surface is investigated systematically using density functional theory with RPBE functional.The adsorption energies,ads
【机 构】
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Institute of Nuclear Physics and Chemistry,Chinese Academy of Engineering Physics,Mianyang 621900
论文部分内容阅读
Adsorption of atomic carbon on δ-Pu(111)surface is investigated systematically using density functional theory with RPBE functional.The adsorption energies,adsorption structures,Mulliken population,work functions,layer and projected density of states are calculated in wide ranges of coverage,which have never been studied before as far as we know.
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