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 | 31 | 2023 |
Application of generalized (hyper-) dual numbers in equation of state modeling P Rehner, G Bauer Frontiers in Chemical Engineering 3, 758090, 2021 | 20 | 2021 |
Three-body effects in triplets of capped gold nanocrystals G Bauer, N Gribova, A Lange, C Holm, J Gross Molecular Physics 115 (9-12), 1031-1040, 2017 | 16 | 2017 |
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 | 13 | 2023 |
Classical density functional theory for interfacial properties of hydrogen, helium, deuterium, neon, and their mixtures M Hammer, G Bauer, R Stierle, J Gross, Ø Wilhelmsen The Journal of Chemical Physics 158 (10), 2023 | 10 | 2023 |
Transferable anisotropic united-atom mie (tamie) force field: Transport properties from equilibrium molecular dynamic simulations M Fischer, G Bauer, J Gross Industrial & Engineering Chemistry Research 59 (18), 8855-8869, 2020 | 10 | 2020 |
Effective potentials between gold nano crystals–functional dependence on temperature G Bauer, A Lange, N Gribova, C Holm, J Gross Molecular Simulation 41 (14), 1153-1158, 2015 | 10 | 2015 |
Force fields with fixed bond lengths and with flexible bond lengths: Comparing static and dynamic fluid properties M Fischer, G Bauer, J Gross Journal of Chemical & Engineering Data 65 (4), 1583-1593, 2020 | 7 | 2020 |
Phase equilibria of solid and fluid phases from molecular dynamics simulations with equilibrium and nonequilibrium free energy methods G Bauer, J Gross Journal of Chemical Theory and Computation 15 (6), 3778-3792, 2019 | 4 | 2019 |
Different ways of looking at the force between two nanocrystals A Lange, F Danecker, G Bauer, N Gribova, J Gross The Journal of Chemical Physics 143 (24), 2015 | 4 | 2015 |
Refrigerant Selection for Heat Pumps: The Compressor Makes the Difference L Neumaier, D Roskosch, J Schilling, G Bauer, J Gross, A Bardow Energy Technology 11 (4), 2201403, 2023 | 3 | 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 |
Don't compress the compressor (model): Integrated design of refrigerants and heat pumps L Rueben, J Schilling, D Roskosch, G Bauer, J Gross, A Bardow 32nd European Symposium on Computer-Aided Process Engineering (ESCAPE-32), 2022 | | 2022 |
Keine Wärmepumpe ohne Verdichter (modell): Integriertes Design von Kältemitteln und Wärmepumpen L Rueben, D Roskosch, J Schilling, G Bauer, J Groß, A Bardow Thermodynamik-Kolloquium 2021. Book of Abstracts, 2021 | | 2021 |
Molecular dynamics study of interactions between nano crystals and solid-liquid phase equilibria G Bauer Stuttgart: Universität Stuttgart, Institut für Technische Thermodynamik und …, 2020 | | 2020 |