Percolation of low-dimensional water at crystalline interfaces

Description

Combining molecular dynamics simulations and thermodynamics calculations, we show that water can be intercalated into crystalline interfaces (graphite and mica interlayers), which is thermodynamically driven under appropriate pressure and temperature conditions. The data (data.docx) here are the pressure-temperature stability limits of monolayer and bilayer water at the crystalline interfaces. Input files for molecular dynamics simulations are in Simulation_input_files.rar, wherein a Read_me.txt file illustrates the input file information.

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