Structural and dynamical properties of m
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Niall J. English; J. M. D. Macelroy
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Article
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2003
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John Wiley and Sons
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English
โ 191 KB
## Abstract Equilibrium molecular dynamics (MD) simulations have been performed in both the NVT and NPT ensembles to study the structural and dynamical properties of fully occupied methane clathrate hydrates at 50, 125, and 200 K. Five atomistic potential models were used for water, ranging from fu