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Force-Field-Based Computational Study of the Thermodynamics of a Large Set of Aqueous Alkanolamine Solvents for Post-Combustion CO2 Capture.

Javad NorooziWilliam R. Smith
Published in: J. Chem. Inf. Model. (2021)
Keyphrases
  • force field
  • higher order
  • active contour model