Diffusivity of CO2 in H2O: A Review of Experimental Studies and Molecular Simulations in the Bulk and in Confinement

HM Polat, FM Coelho, TJH Vlugt… - Journal of Chemical & …, 2024 - ACS Publications
An in-depth review of the available experimental and molecular simulation studies of CO2
diffusion in H2O, which is a central property in important industrial and environmental …

Mutual Diffusivities of Mixtures of Carbon Dioxide and Hydrogen and Their Solubilities in Brine: Insight from Molecular Simulations

T Hulikal Chakrapani, H Hajibeygi… - Industrial & …, 2024 - ACS Publications
H2-CO2 mixtures find wide-ranging applications, including their growing significance as
synthetic fuels in the transportation industry, relevance in capture technologies for carbon …