화학공학소재연구정보센터
Transport in Porous Media, Vol.78, No.1, 101-126, 2009
A Subgrid-Scale Stabilized Finite Element Method for Multicomponent Reactive Transport through Porous Media
Standard Galerkin finite element methods (GFEM) lack stability in solving advection-dominated solute transport in porous media. They usually require prohibitively fine grids and extremely small time steps to solve for advection-dominated problems. The algebraic subgrid-scale stabilized (ASGS) finite element method has been proved to overcome such problems for single-species reactive transport. Its potential for dealing with multicomponent reactive transport has not yet been explored. Here we present a numerical formulation of ASGS for steady and transient multicomponent reactive transport. Subgrid-scale transport equations are solved first by using an ASGS approximation and their solutions are substituted back into the grid-scale equations. A sequential iteration approach (SIA) is used to solve for coupled transport and chemical equations. Coupling of ASGS and SIA, ASGS+SIA, has been implemented in a reactive transport code, CORE2D V4, and verified for conservative solute transport. ASGS+SIA has been tested for a wide range of 1-D transient multicomponent reactive transport problems involving different types of chemical reactions such as: (1) Kinetically controlled aqueous species degradation, (2) Kinetic mineral dissolution, (3) Serial-parallel decay networks, and (4) Cation exchange and pyrite oxidation at local equilibrium. ASGS+SIA always provides accurate solutions and therefore offers an efficient option to solve for advection-dominated multicomponent reactive transport problems.