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- W839003902 abstract "Abstract We have explored interfacial interactions between a Mo–C terminated Mo 2 BC(040) surface and an Al cluster using ab initio molecular dynamics. The Al cluster is disrupted and wets the Mo 2 BC(040) surface. This can be understood based on the electronic structure. Across the Al–MoC interface C s –Al s hybridized states are formed. These bonds are stronger than the Al–Al intra-cluster bonds. Hence, the onset of Al adhesion is caused by bond formation across the Al–MoC interface." @default.
- W839003902 created "2016-06-24" @default.
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- W839003902 date "2015-08-01" @default.
- W839003902 modified "2023-09-26" @default.
- W839003902 title "Atomic scale onset of Al adhesion on Mo2BC" @default.
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- W839003902 doi "https://doi.org/10.1016/j.tsf.2015.06.057" @default.
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