Generating a Machine-Learned Equation of State for Fluid Properties von Zhu, Kezheng, Müller, Erich A

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Optimizing Water Transport through Graphene-Based Membranes: Insights from Nonequilibrium Molecular Dynamics von Muscatello, Jordan, Jaeger, Frederike, Matar, Omar K, Müller, Erich A

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Machine Learning for Fluid Property Correlations: Classroom Examples with MATLAB von Joss, Lisa, Müller, Erich A

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Bulk viscosity of molecular fluids von Jaeger, Frederike, Matar, Omar K., Müller, Erich A.

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Accurate statistical associating fluid theory for chain molecules formed from Mie segments von Lafitte, Thomas, Apostolakou, Anastasia, Avendaño, Carlos, Galindo, Amparo, Adjiman, Claire S, Müller, Erich A, Jackson, George

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SAFT‑γ Force Field for the Simulation of Molecular Fluids. 5. Hetero-Group Coarse-Grained Models of Linear Alkanes and the Importance of Intramolecular Interactions von Rahman, Sadia, Lobanova, Olga, Jiménez-Serratos, Guadalupe, Braga, Carlos, Raptis, Vasilios, Müller, Erich A, Jackson, George, Avendaño, Carlos, Galindo, Amparo

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Force Fields for Coarse-Grained Molecular Simulations from a Corresponding States Correlation von Mejía, Andrés, Herdes, Carmelo, Müller, Erich A

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SAFT-γ Force Field for the Simulation of Molecular Fluids. 1. A Single-Site Coarse Grained Model of Carbon Dioxide von Avendaño, Carlos, Lafitte, Thomas, Galindo, Amparo, Adjiman, Claire S, Jackson, George, Müller, Erich A

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Development of thermodynamically consistent machine-learning equations of state: Application to the Mie fluid von Chaparro, Gustavo, Müller, Erich A.

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Use of Boundary-Driven Nonequilibrium Molecular Dynamics for Determining Transport Diffusivities of Multicomponent Mixtures in Nanoporous Materials von Fayaz-Torshizi, Maziar, Xu, Weilun, Vella, Joseph R, Marshall, Bennett D, Ravikovitch, Peter I, Müller, Erich A

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Molecular Simulation of the Adsorption and Diffusion in Cylindrical Nanopores: Effect of Shape and Fluid⁻Solid Interactions von Cárdenas, Harry, Müller, Erich A

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SAFT‑γ Force Field for the Simulation of Molecular Fluids: 2. Coarse-Grained Models of Greenhouse Gases, Refrigerants, and Long Alkanes von Avendaño, Carlos, Lafitte, Thomas, Adjiman, Claire S, Galindo, Amparo, Müller, Erich A, Jackson, George

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Assembly of porous smectic structures formed from interlocking high-symmetry planar nanorings von Avendaño, Carlos, Jackson, George, Müller, Erich A., Escobedo, Fernando A.

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Resolving Discrepancies in the Measurements of the Interfacial Tension for the CO2 + H2O Mixture by Computer Simulation von Müller, Erich A, Mejía, Andrés

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Equation of state and force fields for Feynman–Hibbs-corrected Mie fluids. I. Application to pure helium, neon, hydrogen, and deuterium von Aasen, Ailo, Hammer, Morten, Ervik, Åsmund, Müller, Erich A., Wilhelmsen, Øivind

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Superspreading: Mechanisms and Molecular Design von Theodorakis, Panagiotis E, Müller, Erich A, Craster, Richard V, Matar, Omar K

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Coarse grained force field for the molecular simulation of natural gases and condensates von Herdes, Carmelo, Totton, Tim S., Müller, Erich A.

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Catalogue of Plausible Molecular Models for the Molecular Dynamics of Asphaltenes and Resins Obtained from Quantitative Molecular Representation von Law, Jason C, Headen, Thomas F, Jiménez-Serratos, Guadalupe, Boek, Edo S, Murgich, Juan, Müller, Erich A

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On the Calculation of Solid-Fluid Contact Angles from Molecular Dynamics von Santiso, Erik, Herdes, Carmelo, Müller, Erich

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Force-Field Parameters from the SAFT-γ Equation of State for Use in Coarse-Grained Molecular Simulations von Müller, Erich A, Jackson, George

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