Marianna Yiannourakou

Molecular Modeling of the Volumetric and Thermodynamic Properties of Kerogen: Influence of Organic Type and Maturity

Philippe Ungerer, Julien Collell, Marianna Yiannourakou · Energy & Fuels · 2014 · 577 citations

Engineering, Organic Chemistry, Experimental Thermodynamics +23

Molecular Simulation of Bulk Organic Matter in Type II Shales in the Middle of the Oil Formation Window

Julien Collell, Philippe Ungerer, Guillaume Galliéro et al. · Energy & Fuels · 2014 · 206 citations

Engineering, Computational Chemistry, Chemistry +18

Transport of Multicomponent Hydrocarbon Mixtures in Shale Organic Matter by Molecular Simulations

Julien Collell, Guillaume Galliéro, Romain Vermorel et al. · The Journal of Physical Chemistry C · 2015 · 203 citations

Molecular simulation and modelisation of methane/ethane mixtures adsorption onto a microporous molecular model of kerogen under typical reservoir conditions

Julien Collell, Guillaume Galliéro, F. Gouth et al. · Microporous and Mesoporous Materials · 2014 · 156 citations

Chemical Engineering, Chemical Kinetics, Engineering +11

Sensitivity of the aggregation behaviour of asphaltenes to molecular weight and structure using molecular dynamics

Philippe Ungerer, David L. Rigby, B.P. LeBlanc et al. · Molecular Simulation · 2013 · 113 citations

Materials Science, Equilibrium Molecular Dynamics, Chemical Thermodynamics +15