New parametrization of a Lennard–Jones force field based on Slater-Kirkwood correlation for computing adsorption on MOFs

Diógenes, Thalles S.; Altino, Sarah A.; Hori, Carla E.; Romanielo, Lucienne L.

doi:10.1007/s10450-024-00535-x

Adsorption

2024

DOI: 10.1007/s10450-024-00535-x

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New parametrization of a Lennard–Jones force field based on Slater-Kirkwood correlation for computing adsorption on MOFs

Thalles S. Diógenes,

Sarah A. Altino,

Carla E. Hori

et al.

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New parametrization of a Lennard–Jones force field based on Slater-Kirkwood correlation for computing adsorption on MOFs

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References 104 publications

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