CO2 adsorption from synthesis gas: modeling the selectivity, capacity and ease of regeneration of new adsorbents (CO2 adsorption from synthesis gas mixtures: understanding and selectivity of new adsorbents)
The design of new environmentally friendly and efficient adsorbents for CO2 separation requires a quantitative link between the adsorbent properties and adsorption capabilities. One can use molecular simulations to generate an empirical correlation between some descriptors of the adsorbent, as the pore diameter, surface area, etc. with macroscopic properties, as the adsorbed amount at a...
