Journal
COMPUTER PHYSICS COMMUNICATIONS
Volume 183, Issue 1, Pages 15-19Publisher
ELSEVIER
DOI: 10.1016/j.cpc.2011.08.005
Keywords
Phase field; Level set; Precipitation; Dissolution; Reaction; Diffusion
Funding
- US Department of Energy [DE-AC05-76RL01830, DE-AC07-051D14517]
- Office of Science Scientific Discovery
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The dynamics of solid-liquid interfaces controlled by solute precipitation and/or dissolution due to the chemical reaction at the interface were computed in two dimensions using a phase field models. Sharp-interface asymptotic analysis demonstrated that the phase field solutions should converge to the proper sharp-interface precipitation/dissolution limit. For the purpose of comparison, the numerical solution of the sharp-interface model for solute precipitation/dissolution was directly solved using a level set method. In general, the phase field results are found in good agreement with the level set results for all reaction rates and geometry configurations investigated. Present study supports the applications of both methods to more complicated and realistic reactive systems, including the nuclear waste release and mineral precipitation and dissolution. (C) 2011 Elsevier B.V. All rights reserved.
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