Open AccessComputational Evaluation of Mg–Salen Compounds as Subsurface Fluid Tracers: Molecular Dynamics Simulations in Toluene–Water Mixtures and Clay Mineral Nanopores
Author(s) -
Jeffery A. Greathouse,
Timothy J. Boyle,
Richard A. Kemp
Publication year - 2018
Publication title -
energy and fuels
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.861
H-Index - 186
eISSN - 1520-5029
pISSN - 0887-0624
DOI - 10.1021/acs.energyfuels.8b00435
Subject(s) - adsorption , solvation , solubility , toluene , kaolinite , montmorillonite , molecular dynamics , nanopore , chemistry , mineral , solvent , chemical engineering , diffusion , chemical physics , mineralogy , organic chemistry , computational chemistry , thermodynamics , physics , engineering
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