4.6 Article

Heat capacity of liquid Al: Molecular dynamics simulations

Journal

PHYSICAL REVIEW B
Volume 72, Issue 13, Pages -

Publisher

AMER PHYSICAL SOC
DOI: 10.1103/PhysRevB.72.132204

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The heat capacities at constant pressure, c(P), at constant volume and at fixed volume, and the isothermal bulk modulus, are calculated for liquid Al over a wide range of temperatures using molecular dynamics simulations with interactions due to Ercolessi and Adams and Mei and Davenport. c(P) has only a weak temperature dependence, with a shallow minimum that results from the opposing effects of a gradual loss of shear resistance and thermal expansion.

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