Bjørk, Rasmus1; Tikare, V.4; Frandsen, Henrik Lund1; Pryds, Nini1
1 Department of Energy Conversion and Storage, Technical University of Denmark2 Electrofunctional materials, Department of Energy Conversion and Storage, Technical University of Denmark3 Mixed Conductors, Department of Energy Conversion and Storage, Technical University of Denmark4 Sandia National Laboratories
Microstructural evolution and sintering behavior of powder compacts composed of spherical particles with different particle size distributions (PSDs) were simulated using a kinetic Monte Carlo model of solid state sintering. Compacts of monosized particles, normal PSDs with fixed mean particle radii and a range of standard deviations, and log-normal PSDs with fixed mode and a range of skewness values were studied. Densification rate and final relative density were found to be inversely proportional to initial PSD width. Grain growth was faster during the early stages of sintering for broad PSDs, but the final grain sizes were smaller. These behaviors are explained by the smallest grains in the broader PSDs being consumed very quickly by larger neighboring grains. The elimination of the small grains reduces both the total number of necks and the neck area between particles, which in turn reduces the regions where vacancies can be annihilated, leading to slower densification rates. The loss of neck area causes grain growth by surface diffusion to become the dominant microstructural evolution mechanism, leading to poor densification. Finally, pore size was shown to increase with the width of PSDs, which also contributes to the lower densification rates.
American Ceramic Society. Journal, 2013, Vol 96, Issue 1, p. 103-110
Computer simulation; Densification; Grain growth; Grain size and shape; Microstructural evolution; Particle size; Size distribution; Sintering; Densification rate; Fixed modes; Grain size; Kinetic Monte Carlo model; Log-normal; Mono-sized particles; Particle radii; Powder compacts; Relative density; Sintering behaviors; Small grains; Solid state sintering; Spherical particle; Standard deviation