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• W1830358639 endingPage "343" @default.
• W1830358639 startingPage "309" @default.
• W1830358639 abstract "The thermodynamic properties of 154 mineral end-members, 13 silicate liquid end-members and 22 aqueous fluid species are presented in a revised and updated data set. The use of a temperature-dependent thermal expansion and bulk modulus, and the use of high-pressure equations of state for solids and fluids, allows calculation of mineral–fluid equilibria to 100 kbar pressure or higher. A pressure-dependent Landau model for order–disorder permits extension of disordering transitions to high pressures, and, in particular, allows the alpha–beta quartz transition to be handled more satisfactorily. Several melt end-members have been included to enable calculation of simple phase equilibria and as a first stage in developing melt mixing models in NCKFMASH. The simple aqueous species density model has been extended to enable speciation calculations and mineral solubility determination involving minerals and aqueous species at high temperatures and pressures. The data set has also been improved by incorporation of many new phase equilibrium constraints, calorimetric studies and new measurements of molar volume, thermal expansion and compressibility. This has led to a significant improvement in the level of agreement with the available experimental phase equilibria, and to greater flexibility in calculation of complex mineral equilibria. It is also shown that there is very good agreement between the data set and the most recent available calorimetric data." @default.
• W1830358639 created "2016-06-24" @default.
• W1830358639 creator A5009637841 @default.
• W1830358639 creator A5030914648 @default.
• W1830358639 date "2004-10-08" @default.
• W1830358639 modified "2023-10-14" @default.
• W1830358639 title "An internally consistent thermodynamic data set for phases of petrological interest" @default.
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