A three-step (feed, delay, and purge), one-column pressure swing adsor
ption reactor has been analyzed. An equilibrium model taking into acco
unt species mass balances, overall mass balance, momentum balance, rea
ction rate, and nonlinear multicomponent adsorption equilibrium isothe
rms was derived to describe the PSA reactor process. Numerical solutio
n of model equations was obtained by using the method of orthogonal co
llocation on finite elements, and simulation results showed that 10-20
% higher conversion than reaction equilibrium conversion in afixed-bed
reactor could be obtained from the PSA reactor for a reversible react
ion A reversible B + C, such as dehydrogenation of ethane to ethylene
and hydrogen on cadmium-exchanged zeolites, where only product B was a
ssumed to be adsorbed. When both reactant A and product B are adsorbed
, 10% higher conversion over the reaction equilibrium limit was observ
ed for pure reactant feed. The effects of system and operating paramet
ers on the process performance of the PSA reactor have been studied, a
s well as the bed dynamics of the PSA reactor at the cyclic steady sta
te.