S TORAGE OF F OSSIL F UEL -D ERIVED C ARBON D IOXIDE B ENEATH THE S URFACE OF THE E ARTH
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November 2001 |
A Guide to CO2 Sequestration
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June 2003 |
CO2 Sequestration in Deep Sedimentary Formations
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October 2008 |
CO2 storage capacity estimation: Methodology and gaps
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October 2007 |
Geochemical Impacts to Groundwater from Geologic Carbon Sequestration: Controls on pH and Inorganic Carbon Concentrations from Reaction Path and Kinetic Modeling
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June 2010 |
A Quantitative Model for Ion Diffusion in Compacted Bentonite
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December 1998 |
Diffusion-driven transport in clayrock formations
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February 2012 |
Modeling and simulation of pore-scale multiphase fluid flow and reactive transport in fractured and porous media
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January 2009 |
In Situ 13 C and 23 Na Magic Angle Spinning NMR Investigation of Supercritical CO 2 Incorporation in Smectite–Natural Organic Matter Composites
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February 2014 |
Role of Cations in CO 2 Adsorption, Dynamics, and Hydration in Smectite Clays under in Situ Supercritical CO 2 Conditions
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December 2016 |
Near-infrared spectroscopic investigation of water in supercritical CO2 and the effect of CaCl2
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January 2013 |
Interaction of carbon dioxide with Na-exchanged montmorillonite at pressures to 640bars: Implications for CO2 sequestration
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May 2012 |
Microstructural Response of Variably Hydrated Ca-rich Montmorillonite to Supercritical CO 2
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June 2014 |
In Situ X-ray Diffraction Study of Na + Saturated Montmorillonite Exposed to Variably Wet Super Critical CO 2
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March 2012 |
X-ray Diffraction Study of K- and Ca-Exchanged Montmorillonites in CO 2 Atmospheres
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April 2012 |
An Integrated Experimental System for Solid-Gas-Liquid Environmental Cells
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December 2014 |
CO 2 Sorption to Subsingle Hydration Layer Montmorillonite Clay Studied by Excess Sorption and Neutron Diffraction Measurements
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August 2012 |
In situ XRD study of Ca2+ saturated montmorillonite (STX-1) exposed to anhydrous and wet supercritical carbon dioxide
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January 2012 |
Evidence of irreversible CO2 intercalation in montmorillonite
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May 2013 |
Competitive sorption of CO2 and H2O in 2:1 layer phyllosilicates
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July 2015 |
Cation Exchange at the Mineral−Water Interface: H 3 O + /K + Competition at the Surface of Nano-Muscovite
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September 2008 |
Molecular dynamics simulations of uranyl adsorption and structure on the basal surface of muscovite
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February 2014 |
Alkali Metal and H 2 O Dynamics at the Smectite/Water Interface
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October 2011 |
Water Dynamics in Hectorite Clays: Infuence of Temperature Studied by Coupling Neutron Spin Echo and Molecular Dynamics
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April 2011 |
The structural environments of cations adsorbed onto clays: 133Cs variable-temperature MAS NMR spectroscopic study of hectorite
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June 1990 |
Structure, Energetics, and Dynamics of Smectite Clay Interlayer Hydration: Molecular Dynamics and Metadynamics Investigation of Na-Hectorite
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March 2013 |
Water Structure and Dynamics in Smectites: X-ray Diffraction and 2 H NMR Spectroscopy of Mg–, Ca–, Sr–, Na–, Cs–, and Pb–Hectorite
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April 2016 |
Water diffusion in a synthetic hectorite by neutron scattering—beyond the isotropic translational model
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February 2008 |
Structure, Energetics, and Dynamics of Cs + and H 2 O in Hectorite: Molecular Dynamics Simulations with an Unconstrained Substrate Surface
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May 2016 |
Multiscale Water Dynamics within Dense Clay Sediments Probed by 2 H Multiquantum NMR Relaxometry and Two-Time Stimulated Echo NMR Spectroscopy
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December 2013 |
Cation and Water Structure, Dynamics, and Energetics in Smectite Clays: A Molecular Dynamics Study of Ca–Hectorite
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June 2016 |
Molecular Simulation of Structure and Diffusion at Smectite–Water Interfaces: Using Expanded Clay Interlayers as Model Nanopores
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July 2015 |
Hydration of Na + , Ni 2+ , and Sm 3+ in the Interlayer of Hectorite: A Quasielastic Neutron Scattering Study
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July 2009 |
Structural and dynamical relationships of Ca2+ and H2O in smectite/2H2O systems
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February 2014 |
Structural Arrangements of Isomorphic Substitutions in Smectites: Molecular Simulation of the Swelling Properties, Interlayer Structure, and Dynamics of Hydrated Cs–Montmorillonite Revisited with New Clay Models
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June 2014 |
Effects of Layer Charge, Charge Location, and Energy Change on Expansion Properties of Dioctahedral Smectites
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January 1992 |
Effects of substrate structure and composition on the structure, dynamics, and energetics of water at mineral surfaces: A molecular dynamics modeling study
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February 2006 |
Simulations of Clay Mineral Swelling and Hydration: Dependence upon Interlayer Ion Size and Charge
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October 2000 |
Microscopic simulation of structure and dynamics of water and counterions in a monohydrated montmorillonite
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August 2002 |
Molecular Computer Simulations of the Swelling Properties and Interlayer Structure of Cesium Montmorillonite
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September 1998 |
In Situ Molecular Spectroscopic Evidence for CO 2 Intercalation into Montmorillonite in Supercritical Carbon Dioxide
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April 2012 |
In Situ Study of CO 2 and H 2 O Partitioning between Na–Montmorillonite and Variably Wet Supercritical Carbon Dioxide
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May 2014 |
FT-IR study of CO2 interaction with Na+ exchanged montmorillonite
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September 2015 |
Clay Hydration/dehydration in Dry to Water-saturated Supercritical CO2: Implications for Caprock Integrity
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January 2013 |
Molecular Dynamics Simulations of Carbon Dioxide Intercalation in Hydrated Na-Montmorillonite
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May 2013 |
Multiphase Monte Carlo and Molecular Dynamics Simulations of Water and CO 2 Intercalation in Montmorillonite and Beidellite
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June 2015 |
Molecular Understanding of CO 2 and H 2 O in a Montmorillonite Clay Interlayer under CO 2 Geological Sequestration Conditions
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February 2016 |
Effect of Layer Charge on CO 2 and H 2 O Intercalations in Swelling Clays
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October 2016 |
Carbon Dioxide in Montmorillonite Clay Hydrates: Thermodynamics, Structure, and Transport from Molecular Simulation
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August 2010 |
Supercritical Carbon Dioxide at Smectite Mineral–Water Interfaces: Molecular Dynamics and Adaptive Biasing Force Investigation of CO 2 /H 2 O Mixtures Nanoconfined in Na-Montmorillonite
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October 2015 |
Molecular dynamics modeling of carbon dioxide, water and natural organic matter in Na-hectorite
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January 2015 |
Molecular dynamics simulations in the grand canonical ensemble: Application to clay mineral swelling
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November 1999 |
Fehlordnung bei Smectiten in Abhängigkeit vom Zwischenschichtkation
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March 2003 |
Geometry and Dynamics of Intercalated Water in Na-Fluorhectorite Clay Hydrates
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January 2008 |
Grand canonical molecular dynamics
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December 2003 |
RASPA: molecular simulation software for adsorption and diffusion in flexible nanoporous materials
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February 2015 |
Molecular Models of Hydroxide, Oxyhydroxide, and Clay Phases and the Development of a General Force Field
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January 2004 |
Molecular Simulation of Carbon Dioxide Capture by Montmorillonite Using an Accurate and Flexible Force Field
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June 2012 |
Rapid estimation of elastic constants by molecular dynamics simulation under constant stress
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April 2004 |
CO2-H2O mixtures in the geological sequestration of CO2. I. Assessment and calculation of mutual solubilities from 12 to 100°C and up to 600 bar
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August 2003 |
A New Two-Constant Equation of State
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February 1976 |
Structure, Energetics, and Dynamics of Water Adsorbed on the Muscovite (001) Surface: A Molecular Dynamics Simulation
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August 2005 |
On the Hydrogen Bonding Structure at the Aqueous Interface of Ammonium-Substituted Mica: A Molecular Dynamics Simulation
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February 2013 |
Hydrogen-bond kinetics in liquid water
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January 1996 |
Dynamics of Halide Ion−Water Hydrogen Bonds in Aqueous Solutions: Dependence on Ion Size and Temperature
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May 2006 |
Resolving the hydrogen bond dynamics conundrum
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December 2000 |
Metal Cation Complexation with Natural Organic Matter in Aqueous Solutions: Molecular Dynamics Simulations and Potentials of Mean Force
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October 2010 |
Smectite fluorination and its impact on interlayer water content and structure: A way to fine tune the hydrophilicity of clay surfaces?
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November 2013 |
Molecular Simulations of Carbon Dioxide and Water: Cation Solvation
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July 2012 |
Structure and dynamics of hydrated ions
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May 1993 |
Structure of Hydrated Gibbsite and Brucite Edge Surfaces: DFT Results and Further Development of the ClayFF Classical Force Field with Metal–O–H Angle Bending Terms
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June 2017 |