TY - DATA
T1 - Sample simulation files for "Transport properties of mixtures of acid gases with aqueous monoethanolamine solutions: A molecular dynamics study"
PY - 2023/02/21
AU - Mert Polat
AU - Thijs Vlugt
AU - Othonas A Moultos
AU - Frederick de Meyer
AU - Celine Houriez
AU - Christophe Coquelet
UR - https://data.4tu.nl/articles/dataset/Sample_simulation_files_for_Transport_properties_of_mixtures_of_acid_gases_with_aqueous_monoethanolamine_solutions_A_molecular_dynamics_study_/22015112/1
DO - 10.4121/22015112.v1
KW - Transport properties
KW - Diffusion coefficients
KW - Viscosity
KW - Density
KW - Molecular Dynamics
KW - LAMMPS
KW - CO2
KW - H2S
N2 - <p>This dataset contains sample simulation input files to run Molecular Dynamics simulations of mixtures of CO2, monoethanolamine (MEA), and water. </p>
ER -