Molecular dynamics simulations of oil transport through inorganic nanopores in shale

S Wang, F Javadpour, Q Feng - Fuel, 2016 - Elsevier
Understanding the transport of liquid hydrocarbon through nanopores of inorganic minerals
is crucial not only to develop liquid-rich shale reservoirs, but also to grasp oil migration from …

Molecular simulations of oil adsorption and transport behavior in inorganic shale

H Sui, F Zhang, Z Wang, D Wang, Y Wang - Journal of Molecular Liquids, 2020 - Elsevier
Oil production from shale has grown dramatically in North America, and has the potential to
do so globally. Understanding the adsorption and transport of liquid hydrocarbon through …

Apparent permeability for liquid transport in nanopores of shale reservoirs: Coupling flow enhancement and near wall flow

Q Zhang, Y Su, W Wang, M Lu, G Sheng - International Journal of Heat and …, 2017 - Elsevier
Multiple mechanisms of oil transport in inorganic and organic nanopores of shale oil
reservoirs are still unclear and possibly more complex than those of gas transport in …

Mechanism of CO2 enhanced oil recovery in kerogen pores and CO2 sequestration in shale: A molecular dynamics simulation study

H Sui, F Zhang, L Zhang, Z Wang, S Yuan, D Wang… - Fuel, 2023 - Elsevier
The strong interactions between kerogen and CO 2 give an opportunity to enhance shale oil
recovery (EOR) by CO 2 injection, and also reduce greenhouse gas emissions through CO 2 …

The utility of Raman spectra in aiding the interpretation of surface structure at aqueous interfaces

MS Azam, D Hore - Journal of Raman Spectroscopy, 2022 - Wiley Online Library
In this perspective, we review how Raman spectroscopy of bulk aqueous phases can assist
in the interpretation of surface‐selective vibrational spectra obtained from visible‐infrared …

Multicomponent shale oil flow in real kerogen structures via molecular dynamic simulation

J Liu, Y Zhao, Y Yang, Q Mei, S Yang, C Wang - Energies, 2020 - mdpi.com
As an unconventional energy source, the development of shale oil plays a positive role in
global energy, while shale oil is widespread in organic nanopores. Kerogen is the main …

Hexadecylamine adsorption at the iron oxide–oil interface

MH Wood, RJL Welbourn, T Charlton, A Zarbakhsh… - Langmuir, 2013 - ACS Publications
The adsorption behavior of a model additive, hexadecylamine, onto an iron surface from
hexadecane oil has been characterized using polarized neutron reflectometry, sum …

Adsorption behaviors of different components of shale oil in quartz slits studied by molecular simulation

C Xue, D Ji, D Cheng, Y Wen, H Luo, Y Li - ACS omega, 2022 - ACS Publications
Understanding the adsorption state and molecular behavior of the diverse components of
shale oil in shale slits is of critical importance for exploring novel enhanced shale oil …

Hydrophobicity of hydroxylated amorphous fused silica surfaces

O Isaienko, E Borguet - Langmuir, 2013 - ACS Publications
Understanding the mechanism of water adsorption on silica is important in many fields of
science and technology, such as geo-and atmospheric chemistry. Vibrational IR–visible sum …

The structure of water–DMF binary mixtures probed by linear and nonlinear vibrational spectroscopy

D Tomar, B Rana, KC Jena - The Journal of Chemical Physics, 2020 - pubs.aip.org
Attenuated total reflectance Fourier transform infrared spectroscopy and sum frequency
generation (SFG) vibrational spectroscopy have been employed to probe the molecular …