Abstract: | ![]() A computational procedure using a modification of Boston and Sullivan's “inside-out” multistage multicomponent separation algorithm (1974) is developed. In order to improve convergence behavior for problems involving mixtures with highly nonideal liquid phases, a two-parameter model is used to describe liquid-phase compositional effects upon the K-factor. The quasi-Newton methods of Mehra et al. (1983) and Nghiem (1983) are applied to solving various sets of solution variables in the proposed algorithm. Activity coefficients are calculated using the UNIQUAC activity-coefficient model (1975) with parameters obtained from the UNIFAC group-contribution method (1975). The computational procedure is applicable to distillation, absorption and reboiled-absorption configurations. The proposed algorithm was implemented in a FORTRAN 77 program and tested on the Honeywell DPS 8/70M computer at the University of Calgary. Inclusion of the liquid-phase model resulted in improved convergence behavior for nonideal systems in which the original “inside-out” method failed to converge. |