Molecular Dynamics Simulation of Diffusion and Electrical Conductivity in Montmorillonite Interlayers

Molecular modeling of water and cation transport in clay mineral nanopores, and a method of obtaining electrical conductivity values from the simulated diffusion coefficients. This method predicts electrical conductivity values for brines and clay phases to aid in the interpretation of well log data.

Data e Risorse

Campo Valore
Citation "\"J. A. Greathouse, R. T. Cygan, J. T. Fredrich and G. R. Jerauld. (2016) Molecular Dynamics Simulation of Diffusion and Electrical Conductivity in Montmorillonite Interlayers. J. Phys. Chem. C, 120, 1640-1649\""
Is NETL associated "\"No\""
Gruppi
  • AmeriGEOSS
  • Global Provider
Tag
  • amerigeo
  • amerigeoss
  • brines
  • ckan
  • clays
  • diffusion
  • edx
  • electrical-conductivity
  • energy
  • energy-data-exchange
  • geo
  • geoss
  • global
  • molecular-modeling
isopen False
license_id No License Restrictions
license_title No License Restrictions
metadata_created 2025-11-25T23:07:11.674581
metadata_modified 2025-11-25T23:07:11.674586
notes Molecular modeling of water and cation transport in clay mineral nanopores, and a method of obtaining electrical conductivity values from the simulated diffusion coefficients. This method predicts electrical conductivity values for brines and clay phases to aid in the interpretation of well log data.
num_resources 1
num_tags 14
title Molecular Dynamics Simulation of Diffusion and Electrical Conductivity in Montmorillonite Interlayers