TY - DATA T1 - Sample simulation files for "Interfacial Tensions, Solubilities, and Transport Properties of the H₂/H₂O/NaCl System: A Molecular Simulation Study" PY - 2023/03/08 AU - W. A. van Rooijen AU - Parsa Habibi AU - Poulumi Dey AU - Thijs Vlugt AU - Hadi Hajibeygi AU - Othonas A Moultos UR - https://data.4tu.nl/articles/dataset/Sample_simulation_files_for_Interfacial_Tensions_Solubilities_and_Transport_Properties_of_the_H_H_O_NaCl_System_A_Molecular_Simulation_Study_/22211650/1 DO - 10.4121/22211650.v1 KW - H2 storage KW - Molecular dynamics KW - Continuous Fractional component Monte Carlo KW - NaCl KW - Aqueous KW - Underground H2 storage N2 -
Sample simulations files used for publication titled "Interfacial Tensions, Solubilities, and Transport Properties of the H2/H2O/NaCl System: A Molecular Simulation Study". Please read the README files in each folder for more information and refer to the main manuscript for more details: https://pubs.acs.org/doi/10.1021/acs.jced.2c00707
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