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MOLECULAR DYNAMICS SIMULATION METHOD FOR CARBON-NANOTUBE REINFORCING METAL MATRIX COMPOSITE
MOLECULAR DYNAMICS SIMULATION METHOD FOR CARBON-NANOTUBE REINFORCING METAL MATRIX COMPOSITE
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机译：碳纳米管增强金属基复合材料的分子动力学模拟方法
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摘要
PURPOSE: the carbon nanometer tube-repair gum metal-base composites in a kind of model molecule dynamics provides a kind of method that the material for preparing ground foundation simulation measurement elasticity modulus passes through prompt molecular dynamics simulation. ;Base aluminum (aluminium) and addition of C NT (carbon NanoTube) and composition simulation unit and Al and CNT is separately provided in CONSTITUTION: one computer. The computer optimization composite material of atomic structure. Computer stable volume basic model and attribute calculate atomic structure Work condition analogue and by minimizing entire energy. Computer calculates stress and applies power to simulation cell and calculate coefficient of elasticity. ;The 2013 of copyright KIPO submissions;[Reference numerals] (AA) starts; (BB) CNT/A1 models are set; (CC) optimize structure; (DD) preparation simulation sample; One flexible (EE) design factor; (FF) terminate
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