selected publications

• academic article

  • Role of Cations in the Methane/Carbon Dioxide Partitioning in Nano- and Mesopores of Illite Using Constant Reservoir Composition Molecular Dynamics Simulation.  The Journal of Physical Chemistry C.  124:2490-2500. 2020
  • Role of Cations in the Methane/Carbon Dioxide Partitioning in Nano- and Mesopores of Illite Using Constant Reservoir Composition Molecular Dynamics Simulation.  The Journal of Physical Chemistry.  2020
  • Understanding methane/carbon dioxide partitioning in clay nano- and meso-pores with constant reservoir composition molecular dynamics modeling.  Physical Chemistry Chemical Physics.  21:6917-6924. 2019
  • Competitive Adsorption of H₂O and CO₂ in 2-Dimensional Nanoconfinement: GCMD Simulations of Cs- and Ca-Hectorites.  The Journal of Physical Chemistry C.  122:23460-23469. 2018
  • Clay Swelling in Dry Supercritical Carbon Dioxide: Effects of Interlayer Cations on the Structure, Dynamics, and Energetics of CO₂ Intercalation Probed by XRD, NMR, and GCMD Simulations.  The Journal of Physical Chemistry C.  122:4391-4402. 2018
  • Molecular Dynamics Study of CO₂ and H₂O Intercalation in Smectite Clays: Effect of Temperature and Pressure on Interlayer Structure and Dynamics in Hectorite.  The Journal of Physical Chemistry C.  121:24527-24540. 2017