Solubility of Carbon Dioxide, Hydrogen Sulfide, Methane, and Nitrogen in Monoethylene Glycol; Experiments and Molecular Simulation

Autor Dawass, Noura, Wanderley, Ricardo R., Ramdin, Mahinder, Moultos, Othonas A., Knuutila, Hanna K., Vlugt, Thijs J. H.
Vydáno v J Chem Eng Data (2020)

Kirkwood-Buff Integrals Using Molecular Simulation: Estimation of Surface Effects

Autor Dawass, Noura, Krüger, Peter, Schnell, Sondre K., Moultos, Othonas A., Economou, Ioannis G., Vlugt, Thijs J. H., Simon, Jean-Marc
Vydáno v Nanomaterials (Basel) (2020)

Brick-CFCMC: Open Source Software for Monte Carlo Simulations of Phase and Reaction Equilibria Using the Continuous Fractional Component Method

Autor Hens, Remco, Rahbari, Ahmadreza, Caro-Ortiz, Sebastián, Dawass, Noura, Erdős, Máté, Poursaeidesfahani, Ali, Salehi, Hirad S., Celebi, Alper T., Ramdin, Mahinder, Moultos, Othonas A., Dubbeldam, David, Vlugt, Thijs J. H.
Vydáno v J Chem Inf Model (2020)