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 …

[HTML][HTML] Densities, viscosities, and diffusivities of loaded and unloaded aqueous CO2/H2S/MDEA mixtures: A molecular dynamics simulation study

HM Polat, C van der Geest, F de Meyer, C Houriez… - Fluid Phase …, 2023 - Elsevier
Experimentally measuring the diffusivities of CO 2 and H 2 S in aqueous alkanolamine
solutions presents an extremely challenging task. To overcome this challenge, we …

Predictive model for the intra-diffusion coefficients of H2 and O2 in vapour H2O based on data from molecular dynamics simulations

OA Moultos, IN Tsimpanogiannis - Molecular Physics, 2023 - Taylor & Francis
Available data from experiments and molecular simulations for the intra-diffusivities of H 2
and O 2 in H 2 O, and for the self-diffusivity of pure H 2 O (at pressure and temperature …

[HTML][HTML] Removal of marine NOx, SOx, and CO2 from flue gas: Simulation and experiment on a pilot plant

NVD Long, DY Lee, C Kwag, YM Lee, SW Lee… - Separation and …, 2025 - Elsevier
Flue gas treatment typically involves multiple scrubbing and absorbing stages, which
increases capital and operating costs and requires large spaces; this process is particularly …

Thermophysical Properties and Phase Behavior of CO2 with Impurities: Insight from Molecular Simulations

D Raju, M Ramdin, TJH Vlugt - Journal of Chemical & Engineering …, 2024 - ACS Publications
Experimentally determining thermophysical properties for various compositions commonly
found in CO2 transportation systems is extremely challenging. To overcome this challenge …

Heat Capacity of CO2-Loaded Aqueous Methyldiethanolamine + Piperazine + Sulfolane Solutions

AH Jalili, M Shokouhi, A Mehdizadeh… - Journal of Chemical & …, 2024 - ACS Publications
Heat capacities of CO2-loaded aqueous N-methyldiethanolamine (MDEA) and piperazine
(PZ) and sulfolane (SFL) solutions were experimentally measured. MDEA, PZ, and SFL …

Latest technological advances and insights into capture and removal of hydrogen sulfide: a critical review

MS Aminuddin, MA Bustam, K Johari - RSC Sustainability, 2024 - pubs.rsc.org
Hydrogen sulfide is an extremely toxic, poisonous and flammable gas often found in natural
gas streams and crude oil reservoirs. Due to its hazardous and corrosive nature, it must be …

Process modeling and simulation of natural gas sweetening by absorption processes

AB Vakylabad - Advances Natural Gas: Formation, Processing, and …, 2024 - Elsevier
Natural gas sweetening is an essential process in the oil and gas industry to remove
impurities like hydrogen sulfide (H 2 S) and carbon dioxide (CO 2) from raw natural gas. This …

Thermophysical Properties and Phase Behavior of CO2 with Impurities

D Raju, M Ramdin, TJH Vlugt - 2024 - repository.tudelft.nl
Experimentally determining thermophysical properties for various compositions commonly
found in CO 2 transportation systems is extremely challenging. To overcome this challenge …

Absorption de gaz acides par de nouveaux solvants chimiques: Expériences et modélisation

S Delgado - 2022 - pastel.hal.science
Dans le contexte du traitement du gaz naturel, nous étudions l'absorption de CO2 par un
mélange aqueux de méthyldiéthanolamine (MDEA) et de pipérazine (PZ), qui a une grande …