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cond-mat.mtrl-sci2021
Atomistic aspects of load transfer and fracture in CNT-reinforced aluminium
Samaneh Nasiri, Kai Wang, Mingjun Yang +3
This paper describes atomistic simulations of deformation and fracture of Al reinforced with carbon nanotubes (CNTs). We use density functional theory (DFT) to understand the energ…
cond-mat.mtrl-sci2019
Nickel coated carbon nanotubes in aluminum matrix composites: A multiscale simulation study
Samaneh Nasiri, Kai Wang, Mingjun Yang +2
In this work we use density functional theory (DFT) calculations to benchmark empirical potentials for the interaction between nickel and sp bonded carbon nanoparticles. These…