Modeling of surface phenomena of liquid Al-Ni alloys using molecular dynamics.

This work presents a study on the surface tension of liquid Aluminum-Nickel (Al-Ni) alloys. Obtaining adequate values of surface tension for this system is not a simple task as these alloys present the formation of atomic clusters with short-range order at certain compositions, which dramatically influences surface tension. The Compound Forming Model predicts the influence of these clusters on surface tension, but experimental limitations have obstructed its validation due to deficient thermodynamic data.

Study of the effect of Sn grain boundaries on IMC morphology in solid state inter-diffusion soldering.

This paper reports on 3D phase field simulations of IMC growth in Co/Sn and Cu/Sn solder systems. In agreement with experimental micrographs, we obtain uniform growth of the CoSn phase in Co/Sn solder joints and a non-uniform wavy morphology for the CuSn phase in Cu/Sn solder joints. Furthermore, simulations were performed to obtain an insight in the impact of Sn grain size, grain boundary versus bulk diffusion, IMC/Sn interface mobility and Sn grain boundary mobility on IMC morphology and growth kinetics.

Metal losses in pyrometallurgical operations - A review.

Nowadays, a higher demand on a lot of metals exists, but the quantity and purity of the ores decreases. The amount of scrap, on the other hand, increases and thus, recycling becomes more important. Besides recycling, it is also necessary to improve and optimize existing processes in extractive and recycling metallurgy.

Microstructure and degradation performance of biodegradable Mg-Si-Sr implant alloys.

In this work the microstructure and degradation behavior of several as-cast alloy compositions belonging to the Mg rich corner of the Mg-Si-Sr system are presented and related. The intermetallic phases are identified and analyzed describing the microstructure evolution during solidification. It is intended in this work to obtain insight in the behavior of the ternary alloys in in vitro tests and to analyze the degradation behavior of the alloys under physiologically relevant conditions.

Bounding box algorithm for three-dimensional phase-field simulations of microstructural evolution in polycrystalline materials.

Phase-field modeling has proven to be a versatile tool for simulating microstructural evolution phenomena, such as grain growth in polycrystalline materials. However, the computing time and computing memory requirements of a phase-field model pose severe limitations on the number of phase-field variables that can be taken into account in a practical implementation. In this paper, a sparse bounding box algorithm is proposed that allows the use of a large number of phase-field variables without excessive memory usage or computational requirements.