[1] Walker, P.J., Yew, H-W., Riedeman, A., 2022. ‘Clapeyron.jl: An Extensible, Open-Source Fluid Thermodynamics Toolkit’, Industrial and Engineering Chemistry Research, 61, 20, pp. 7130-7153
[2] Walker, P.J., Riedemann, A., Wang, Z-G., 2024. ‘GCIdentifier.jl: A Julia package for identifying molecular fragments from SMILES’, Journal of Open-Source Software, 9, 96, pp. 6453.
[3] Walker, P.J., Mueller, S., Smirnova, I., 2023. ‘Confidence Interval and Uncertainty Propagation Analysis of SAFT-type Equations of State’, Journal of Chemical and Engineering Data, 69, 2, pp. 495-508.
[4] Walker, P.J., 2022. ‘Towards advanced, predictive mixing rules in SAFT equations of state’, Industrial Engineering and Chemistry Research, 61, 49, pp. 18165–18175.
[5] Ylitalo, A.S., Chao, H., Walker., P.J., Fitzgibbons, T.C., Ginzburg, V.G., Zhou, W., Wang, Z.-G., Di Maio, E., Kornfield, J.A., 2022. ‘Competition between CO2-philicity and mixing entropy leads to CO2 solubility maximum in polyether polyols’, Industrial and Engineering Chemistry Research, 61, 34, pp. 12835–12844.
[6] Walker, P.J., Zhao, T., Haslam, A.J., Jackson, G., 2022. ‘Ab initio development of generalized Lennard-Jones (Mie) force fields for predictions of thermodynamic properties in advanced molecular-based SAFT equations of state’, Journal of Chemical Physics, 156, pp. 154106.
[7] Walker, P.J., Liang, X., Kontogeorgis, G.M., 2022. ‘Importance of the Relative Static Permittivity in Electrolyte SAFT-VR Mie Equations of state’, Fluid Phase Equilibria, 551, pp. 113256
[8] Inguva, P.K., Walker, P.J., Zhu, K., Yew, H-W., Haslam, A.J., Matar, O.K., 2021. ‘Continuum-scale modelling of polymer blends using the Cahn–Hilliard equation: Transport and thermodynamics’, Soft Matter, 17, pp. 5645-5665.
[9] Walker, P. J., Haslam, A. J., 2020. ‘A new predictive group-contribution ideal-heat-capacity model, and its influence on second-derivative properties calculated using a free-energy equation of state’, Journal of Chemical and Engineering Data, 65(12), pp. 5809-5829.
[10] Paoli, L., Inguva, P.K., Haslam, A.J., Walker, P.J., 2024. ‘Introducing students to research codes: An introductory course to computational thermodynamics in Julia’, Education for Chemical Engineers, 48, pp. 1-14.