An empirical model for predicting saturation pressure of pure hydrocarbons in nanopores
Due to the confinement and strong adsorption to the pore wall in meso-and nano pores, fluid
phase behavior in the confined media, such as the tight and shale reservoirs, can be …
phase behavior in the confined media, such as the tight and shale reservoirs, can be …
[HTML][HTML] Influence of layer slipping on adsorption of light gases in covalent organic frameworks: A combined experimental and computational study
C Kessler, R Schuldt, S Emmerling, BV Lotsch… - Microporous and …, 2022 - Elsevier
Sorption of gases in micro-and mesoporous materials is typically interpreted on the basis of
idealized structural models where real structure effects such as defects and disorder are …
idealized structural models where real structure effects such as defects and disorder are …
Quantification of CO2 Uptake Capacity in Source Rock Shales for Geologic Carbon Sequestration: A 13C Nuclear Magnetic Resonance Spectroscopy Method
Geologic carbon sequestration (GCS) is an accepted technology to reduce anthropogenic
carbon dioxide (CO2) from the atmosphere. To determine the suitability of underground …
carbon dioxide (CO2) from the atmosphere. To determine the suitability of underground …
Accurate Prediction of the Saturation Pressures of Hydrocarbons in Unconventional Reservoirs: A Modified Alpha-Function for the Peng-Robinson Equation of State
L Lin, T Babadagli, HA Li - SPE Annual Technical Conference and …, 2023 - onepetro.org
Due to the confinement and strong adsorption to the pore wall in meso-and nano-pores, fluid
phase behavior in the confined media, such as the tight and shale reservoirs, can be …
phase behavior in the confined media, such as the tight and shale reservoirs, can be …
Hydrogen adsorption simulations in isomorphous borohydride and imidazolate frameworks: Evaluations using interpolation
We simulate hydrogen adsorption on two topologically identical crystalline solids using the
grand canonical Monte Carlo (GCMC) method. One solid is the γ-magnesium borohydride, γ …
grand canonical Monte Carlo (GCMC) method. One solid is the γ-magnesium borohydride, γ …
Calculating adsorption isotherms using Lennard Jones particle density distributions
A Gotzias - Journal of Physics: Condensed Matter, 2019 - iopscience.iop.org
The computation of particle density distributions in pore channels is a fundamental post
process practice in molecular adsorption simulations. The distributions, although not …
process practice in molecular adsorption simulations. The distributions, although not …