Chapter 1 Introduction
1.1 Background
1.2 Problem Statement
1.3 Research Objectives
1.4 Book Structure
Chapter 2 Molecular Dynamics Simulation Study of Carbon Dioxide, Methane, and Their Mixture in the Presence of Brine
2.1 Abstract
2.2 Introduction
2.3 Simulation Details
2.4 Results and Discussion
2.5 Conclusion
Chapter 3 Effect of Ion Valency on the Properties of the Brine in Contact with Carbon Dioxide and Methane
3.1 Abstract
3.2 Introduction
3.3 Molecular Dynamics Simulation
3.4 Theoretical Details
3.5 Results and Discussion
3.6 Conclusions
Chapter 4 Adsorption and Diffusion of Methane and Carbon Dioxide in Amorphous Regions of Cross-linked Polyethylene: A Molecular Simulation Study
4.1 Abstract
4.2 Introduction
4.3 Simulation Details
4.4 Results and Discussion
4.5 Conclusions
Chapter 5 Adsorption and Diffusion of Carbon Dioxide, Methane, and Their Mixture in Carbon Nanotubes in the Presence of Water
5.1 Abstract
5.2 Introduction
5.3 Simulation Details
5.4 Theoretical Details
5.5 Results and Discussion
5.6 Conclusions
Chapter 6 Conclusion and Future Work
References
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