| Surface tension of droplets and Tolman lengths of real substances and mixtures from density functional theory P Rehner, J Gross The Journal of chemical physics 148 (16), 2018 | 34 | 2018 |
| Guide to efficient solution of PC-SAFT classical Density Functional Theory in various Coordinate Systems using fast Fourier and similar Transforms R Stierle, E Sauer, J Eller, M Theiss, P Rehner, P Ackermann, J Gross Fluid Phase Equilibria 504, 112306, 2020 | 33 | 2020 |
| FeOs: An Open-Source Framework for Equations of State and Classical Density Functional Theory P Rehner, G Bauer, J Gross Industrial & Engineering Chemistry Research 62 (12), 5347-5357, 2023 | 30 | 2023 |
| Multiobjective optimization of PCP-SAFT parameters for water and alcohols using surface tension data P Rehner, J Gross Journal of Chemical & Engineering Data 65 (12), 5698-5707, 2020 | 28 | 2020 |
| Tolman lengths and rigidity constants from free-energy functionals—General expressions and comparison of theories P Rehner, A Aasen, Ø Wilhelmsen The Journal of Chemical Physics 151 (24), 2019 | 28 | 2019 |
| Surfactant modeling using classical density functional theory and a group contribution PC-SAFT approach P Rehner, B Bursik, J Gross Industrial & Engineering Chemistry Research 60 (19), 7111-7123, 2021 | 27 | 2021 |
| Application of generalized (hyper-) dual numbers in equation of state modeling P Rehner, G Bauer Frontiers in Chemical Engineering 3, 758090, 2021 | 20 | 2021 |
| Predictive density gradient theory based on nonlocal density functional theory P Rehner, J Gross Physical Review E 98 (6), 063312, 2018 | 17 | 2018 |
| PCP-SAFT parameters of pure substances using large experimental databases T Esper, G Bauer, P Rehner, J Gross Industrial & Engineering Chemistry Research 62 (37), 15300-15310, 2023 | 12 | 2023 |
| Equation of state and Helmholtz energy functional for fused heterosegmented hard chains P Rehner, T van Westen, J Gross Physical Review E 105 (3), 034110, 2022 | 6 | 2022 |
| Molecule superstructures for computer-aided molecular and process design P Rehner, J Schilling, A Bardow Molecular Systems Design & Engineering 8 (4), 488-499, 2023 | 5 | 2023 |
| Interfacial properties using classical density functional theory: curved interfaces and surfactants P Rehner Stuttgart: Universität Stuttgart, Institut für Technische Thermodynamik und …, 2021 | 4 | 2021 |
| Understanding the language of molecules: Predicting pure component parameters for the PC-SAFT equation of state from SMILES B Winter, P Rehner, T Esper, J Schilling, A Bardow arXiv preprint arXiv:2309.12404, 2023 | 3 | 2023 |
| Modeling Mixtures with PCP-SAFT: Insights from Large-Scale Parametrization and Group-Contribution Method for Binary Interaction Parameters P Rehner, A Bardow, J Gross International Journal of Thermophysics 44 (12), 179, 2023 | 2 | 2023 |
| Modeling mixtures with PC-SAFT: Insights from large-scale parametrization and group-contribution method for binary interaction parameters P Rehner, A Bardow, J Gross | 2 | 2023 |
| Predicting the relative static permittivity: a group contribution method based on perturbation theory L Rueben, J Schilling, P Rehner, S Müller, T Esper, A Bardow, J Gross Journal of chemical & engineering data 69 (2), 414-426, 2023 | 2 | 2023 |
| Classical density functional theory in three dimensions with GPU-accelerated automatic differentiation: computational performance analysis using the example of adsorption in … R Stierle, G Bauer, N Thiele, B Bursik, P Rehner, J Gross Chemical Engineering Science, 120380, 2024 | 1 | 2024 |
| Computer-aided molecular refrigerant design for adsorption chillers based on classical density functional theory and PC-SAFT F Mayer, L Spiekermann, L Rueben, P Rehner, J Seiler, J Schilling, ... Computers & Chemical Engineering 184, 108629, 2024 | 1 | 2024 |
| Classical Density Functional Theory as a Fast and Accurate Method for Adsorption Property Prediction of Porous Materials V Dufour-Décieux, P Rehner, J Schilling, E Moubarak, J Gross, A Bardow | | 2024 |
| Generic low-density corrections to the equation of state of chain molecules with repulsive intermolecular forces T van Westen, P Rehner, TJH Vlugt, J Gross The Journal of Chemical Physics 160 (17), 2024 | | 2024 |
Joachim GrossUniversity of Stuttgart在 itt.uni-stuttgart.de 的电子邮件经过验证
