| 1 |
Entropy in Molecular Fluids: Interplay between Interaction Complexity and Criticality
Desgranges C, Delhommelle J
Journal of Physical Chemistry B, 124(50), 11463, 2020 |
| 2 |
Viscosity of a highly compressed methylated alkane via equilibrium and nonequilibrium molecular dynamics simulations
Valencia-Jaime I, Desgranges C, Delhommelle J
Chemical Physics Letters, 719, 103, 2019 |
| 3 |
Determination of mixture properties via a combined Expanded Wang-Landau simulations-Machine Learning approach
Desgranges C, Delhommelle J
Chemical Physics Letters, 715, 1, 2019 |
| 4 |
Prediction of the boiling and critical points of polycyclic aromatic hydrocarbons via Wang-Landau simulations and machine learning
Groven SD, Desgranges C, Delhommelle J
Fluid Phase Equilibria, 484, 225, 2019 |
| 5 |
Nucleation of Capillary Bridges and Bubbles in Nanoconfined CO2
Desgranges C, Delhommelle J
Langmuir, 35(47), 15401, 2019 |
| 6 |
Calculating free energy profiles using entropy as a reaction coordinate: Application to water nucleation
Desgranges C, Delhommelle J
Chemical Physics Letters, 695, 194, 2018 |
| 7 |
Ginzburg-Landau free energy for molecular fluids: Determination and coarse-graining
Desgranges C, Delhommelle J
Chemical Physics Letters, 669, 218, 2017 |
| 8 |
Similarity law and critical properties in ionic systems
Desgranges C, Delhommelle J
Chemical Physics Letters, 687, 9, 2017 |
| 9 |
Coarse-Grained Model and Boiling Point Prediction for Asphaltene Model Compounds via HMC-WL Simulations
Desgranges C, Delhommelle J
Energy & Fuels, 31(10), 10699, 2017 |
| 10 |
Benchmark Free Energies and Entropies for Saturated and Compressed Water
Desgranges C, Delhommelle J
Journal of Chemical and Engineering Data, 62(11), 4032, 2017 |
