Improving hypercrosslinked polymer CO2/N2 selective separation through tuning polymer's porous properties: Optimization using RSM-BBD

This study investigates the effect of synthesis and operating parameters on the adsorption of CO 2 and N 2 and the CO 2 /N 2 selectivity of a hypercrosslinked adsorbent based on waste-expanded polystyrene. Six factors were examined, including synthesis time, crosslinker and catalyst amounts, adsorption temperature and pressure, and CO 2 percentage in the mixture. The response surface methodology (RSM) and ideal adsorbed solution theory (IAST) were employed to design the experiment. After synthesizing 19 adsorbents under different conditions, characterization tests were conducted. Results indicate that the specific surface area and micropore volume initially increase and then decrease with increased synthesis time, crosslinker, and catalyst amounts. The highest specific surface area and micropore volume were 803.84 m 2 /g and 0.1355 cm 3 /g, respectively. CO 2 /N 2 selectivity and the adsorption of CO 2 and N 2 also increase and decrease with increased synthesis parameters. Furthermore, it was observed that CO 2 adsorption and CO 2 /N 2 selectivity increased with an increase in pressure and CO 2 percentage and a decrease in temperature, while N 2 adsorption decreased. The adsorbents were optimized using RSM to maximize CO 2 adsorption and CO 2 /N 2 selectivity with a target of 15 % CO 2 in the gas mixture. The optimal synthesis parameters for the hypercrosslinked adsorbent, including synthesis time, crosslinker, and catalyst amounts, were determined to be approximately 13 hours, 30 mmol, and 30 mmol, respectively. Under optimal conditions for flue gas applications (CO 2 :N 2 /15:85), the adsorbent demonstrated a CO 2 /N 2 selectivity of 11.05, making it suitable for flue gas capture. • Various hyper-cross-linked polymers were developed from waste polystyrene for CO 2 /N 2 uptake. • IAST coupled RSM technique was employed to model and optimize CO 2 /N 2 adsorption. • Tuning HCP’s morphology during synthesis yielded enhanced CO 2 /N 2 adsorption selectivity. • Isotherm and kinetic modeling exhibited physically CO 2 /N 2 adsorption mechanism.