Intro
Supervisor's Foreword
Abstract
Acknowledgements
Contents
1 Introduction
1.1 Basic Introduction to Interfacial Water
1.2 Research Status of Interfacial Water
1.2.1 Experimental Studies of Interfacial Water
1.2.2 Application of AFM Imaging in the Study of Interfacial Water
1.2.3 Theoretical Research on Interfacial Water
1.3 Chapter Summary and Main Content of This Book
References
2 Theoretical Research Methods Involved in This Book
2.1 First-Principles Calculations and DFT
2.2 Classical MD Simulation
2.3 Simulation of FM-AFM Imaging

2.3.1 Basic Principle of FM-AFM
2.3.2 Probe Particle Model
2.3.3 High-Resolution Imaging Mechanism of the Weakly Perturbative CO Tip
2.4 Chapter Summary
References
3 Structure and Growth Mechanism of the 2D Ice on the Hydrophobic Metal Surface
3.1 Introduction
3.2 Structure of the Bulk 2D Ice on Au(111)
3.2.1 Periodicity and Layer Number of the 2D Ice
3.2.2 Structure of the Bulk 2D Ice
3.3 Structure and Stability of the Ice Edges
3.4 Growth Mechanism of the Ice Edges
3.5 Chapter Summary
References

4 Interconversion of the Eigen/Zundel Cations on Metal Surfaces
4.1 Introduction
4.2 Structure of Hydrated Protons on Au(111)
4.2.1 Eigen State
4.2.2 Zundel State
4.3 Comparison and Interconversion of Eigen/Zundel Cations
4.3.1 Theoretical Comparison of the Interaction Strength in Different States
4.3.2 Interconversion Between Eigen State and Zundel State
4.3.3 Change of the Eigen/Zundel Ratio
4.4 Structure of the Hydrated Protons on Pt(111)
4.5 Chapter Summary
References
5 Structure and Dynamics of Ion Hydrates on NaCl surface
5.1 Introduction

5.2 Structure of Na+ Hydrates on NaCl(001)
5.2.1 Determination of the Electrical Property of Na in Hydrates
5.2.2 Structure of Na+ Hydrates
5.3 Dynamics of Na+ Hydrates on NaCl(001)
5.3.1 Experimental Results of the Dynamics of Na+ Hydrates
5.3.2 DFT Study of the Dynamics of Na+ Hydrates
5.3.3 Classical MD Simulation of the Dynamics of Na+ Hydrates
5.4 Dynamics of Other Salt Ion Hydrates
5.5 Chapter Summary
References
6 Summary and Outlook