THE STATIC DIELECTRIC-CONSTANT OF WATER AT PRESSURES UP TO 20 KBAR AND TEMPERATURES TO 1273-K - EXPERIMENT, SIMULATIONS, AND EMPIRICAL EQUATIONS

The static dielectric constant of water was calculated by molecular dynamics simulations using the SPC/E water model up to 1273 K and pressures to 20 kbar. Simulations within the pressure-temperature range (up to 5 kbar and 823 K) of the available experimental data yield dielectric constant (ε) in v...

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Bibliographic Details
Main Authors: Wasserman, E, Wood, B, Brodholt, J
Format: Journal article
Published: 1995