Density, Speed of Sound, Compressibility and Related Excess Properties of Methane + n-Heptane at T = 303.15 K and p = 10 to 70 MPa

Bazile, Jean-Patrick; Nasri, Djamel; Hoang, Hai; Galliéro, Guillaume; Daridon, Jean-Luc

doi:10.1007/s10765-020-02694-9

Cited by 6 publications

(1 citation statement)

References 52 publications

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“…Such tools are especially useful for providing data under a range of conditions that would be arduous or even impossible to measure experimentally. The availability of data is crucial to the industry, since the thermodynamic properties of the materials affect design, cost, and process operation. − …”

Section: Introductionmentioning

confidence: 99%

Derivative Properties Data for Hydrogen–Ethylene Supercritical Mixtures Using a SAFT EoS and a SAFT Force Field

et al. 2020

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Hydrogen is a promising component for a more sustainable world, but its wide application depends upon the development of new technologies and processes. Therefore, a reliable set of thermodynamic properties is of paramount importance. Statistical mechanics provides the necessary tools to build very accurate molecular-based models for a given interaction potential. Statistical associating fluid theory (SAFT) entails a family of such models. From such molecular-based equations of state, new coarse-grained force fields can be derived for molecular simulations. In this work, we applied the SAFT-γ Mie force field to generate extensive data for derivative properties of supercritical hydrogen–ethylene mixtures at 300 K, comparing the results with the SAFT-VR Mie equation of state.

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