59 citations · 60 across the 4 of their papers we have counts for
4 papers
Thermophysical Properties and Phase Behavior of CO2 with Impurities: Insight from Molecular Simulations
Darshan Raju, Mahinder Ramdin, Thijs J. H. Vlugt
Experimentally determining thermophysical properties for various compositions commonly found in CO2 transportation systems is extremely challenging. To overcome this challenge, we…
Finite-size effects of the excess entropy computed from integrating the radial distribution function
Darshan Raju, Mahinder Ramdin, Jean-Marc Simon +2
Computation of the excess entropy from the second-order density expansion of the entropy holds strictly for infinite systems in the limit of small densities. For the reliable and e…
Computing solubility and thermodynamics properties of H2O2 in water
Tijin H. G. Saji, José Manuel Vicent-Luna, Thijs J. H. Vlugt +2
Hydrogen peroxide plays a key role in many environmental and industrial chemical processes. We performed classical Molecular Dynamics and Continuous Fractional Component Monte Carl…
Ensemble Theory for Force Networks in Hyperstatic Granular Matter
Jacco H. Snoeijer, Thijs J. H. Vlugt, Wouter G. Ellenbroek +2
An ensemble approach for force networks in static granular packings is developed. The framework is based on the separation of packing and force scales, together with an a-priori fl…