Second derivative of alpha functions in cubic equations of state

التفاصيل البيبلوغرافية
العنوان: Second derivative of alpha functions in cubic equations of state
المؤلفون: Maryam Sedigh, Peyman Mahmoodi
المصدر: The Journal of Supercritical Fluids. 120:191-206
بيانات النشر: Elsevier BV, 2017.
سنة النشر: 2017
مصطلحات موضوعية: Series (mathematics), Chemistry, General Chemical Engineering, Thermodynamics, 02 engineering and technology, Classification of discontinuities, 021001 nanoscience & nanotechnology, Condensed Matter Physics, Supercritical fluid, Exponential function, symbols.namesake, Alpha (programming language), 020401 chemical engineering, Taylor series, symbols, 0204 chemical engineering, Physical and Theoretical Chemistry, 0210 nano-technology, Cubic function, Second derivative
الوصف: In this paper, a mathematical study of the second derivatives of five well-established alpha functions (Mathias–Copeman, Coquelet et al., Twu et al., Stryjek–Vera and Heyen) for cubic equation of state, CEoS, is performed. For alpha functions having different formulations in the subcritical and supercritical temperature ranges, like those by Mathias–Copeman and Coquelet et al., undesired discontinuities are highlighted at the critical temperature. A method for fixing such discontinuities is presented and its validity is tested by predicting C v and C p values. Moreover, an exponential form of Soave alpha function with consistent derivatives by means of Taylor series expansion is proposed. In a second step, 21 thermodynamic packages (combination of a cubic EoS and an alpha function) are tested to predict sub and super critical properties of a series of pure components. Our study makes it possible to conclude that the Mathias–Copeman and Coquelet et al. alpha functions have the best accuracy. At supercritical temperatures Soave alpha function is superior to studied exponential alpha functions.
تدمد: 0896-8446
DOI: 10.1016/j.supflu.2016.05.012
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::46f0ed9fc7cd9e37b97b7151b3d751d4
https://doi.org/10.1016/j.supflu.2016.05.012
Rights: CLOSED
رقم الانضمام: edsair.doi...........46f0ed9fc7cd9e37b97b7151b3d751d4
قاعدة البيانات: OpenAIRE
الوصف
تدمد:08968446
DOI:10.1016/j.supflu.2016.05.012