Dissociation of methane into hydrocarbons at extreme (planetary) pressure and temperature.

Physics

Scientific paper

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Planetary Atmospheres: Laboratory Simulations, Planetary Atmospheres: Methane, Planetary Atmospheres: Hydrocarbons

Scientific paper

Constant-pressure, first-principles molecular dynamic simulations were used to investigate the behavior of methane at high pressure and temperature. The simulations suggest that, below 100 GPa, methane dissociates into a mixture of hydrocarbons, and it separates into hydrogen and carbon only above 300 GPa. The simulation conditions (100 to 300 GPa; 4000 to 5000K) were chosen to follow the isentrope in the middle ice layers of Neptune and Uranus. Implications on the physics of these planets are discussed.

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