Insights into the diffusion migration behavior of alloy atoms at the graphene/aluminum interface: First-principles calculations
Jingtao Huang, Mingwei Li, Jiaying Chen, Yuan Cheng, Zhonghong Lai, Jin Hu, Fei Zhou, Nan Qu, Yong Liu, Jingchuan Zhu
Topics & Concepts
Materials scienceGrapheneAluminiumVacancy defectAlloyDiffusionAtom (system on chip)Density functional theoryChemical physicsMolecular dynamicsCarbon fibersCondensed matter physicsNanotechnologyComposite materialComputational chemistryThermodynamicsComposite numberPhysicsEmbedded systemComputer scienceChemistryAluminum Alloys Composites PropertiesGraphene research and applicationsAdvanced ceramic materials synthesis