A Monte Carlo (MC) and molecular dynamics (MD) coupling simulation scheme for sputtered particle transport was first proposed in this work. In this scheme, the MC method was utilized to model the free-flight process of sputtered atoms, while the MD model was adopted to simulate the collision between the sputtered atom and background gas atom so as to self-consistently calculate the post-collision velocity of the sputtered atom. The reliability of the MD collision model has been verified by comparing the computation results of the MD model and of an analytical model. This MC-MD coupling simulation scheme was used to investigate the influence of target-substrate distance on the transport characteristic parameters of sputtered Cu atoms during magnetron sputtering discharge. As the target-substrate distance increased from 30 to 150 mm, the peak energy of the incident energy distribution of deposited Cu atoms decreased from 2 to 1 eV due to the gradual thermalization of sputtered atoms. The distribution of differential deposition rate in unit solid angle firstly became more forward-peaked and then reversely approached the cosine distribution, which was agreed with the existing experimental observations. This work is expected to provide a more realistic simulation scheme for sputtered particle transport, which can be further combined with the MD simulation of sputtered film growth to explore the influence mechanism of process parameters on the properties of sputtered film.

Reinforcement corrosion is the most common deterioration problem observed in reinforced concrete (RC) structures located at coastal or cold regions. The corrosion process can impact the performance of these structures by inducing damage on the bonding action between concrete and steel, either by the splitting of the concrete cover due to the volumetric expansion of corrosion products or the lubricant effect at the steel/concrete interface as the corrosion by-products accumulate. The current research aims at investigating corrosion-induced deterioration of bond between steel and concrete through finite element (FE) analysis of the flexural behaviour of corroded RC components. By treating the concrete cover as a thick-wall cylinder subjected to internal pressure, the analytical evaluation of impaired bond capacity is studied first and verified against published bonding tests. Then, the formulation of a numerical model is performed using ABAQUS, wherein a link element to simulate the bond behaviour is formulated and implemented through the ABAQUS user-subroutine (UEL) feature according to the validated analytical model. By introducing corrosion-induced damages, i.e., smaller cross-sectional area of reinforcement, splitting of concrete and bond deterioration, in the FE analyses, the results of the numerical model show good agreement with experimental observations. Upon validation of the analytical and FE models, a parametric investigation is conducted, wherein the effects of concrete strength, dimension of reinforcing bars, properties of oxide products, different corrosion damage mechanisms and the corrosion location along the longitudinal reinforcement on the flexural behaviour of RC beams are studied.The results show that the analytical evaluation for bond degradation is impacted by the selection of the post-cracking material model and the thickness of cover that determine the 'holding capacity' after cracking initiation. Also, the density of rust by-products affects the results of the analytical model at high corrosion levels. From the FE model results, it was observed that each damage tc

Centerfor civil-military inosculation and development of new material industry in Huludao City, Huludao,

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