دورية أكاديمية

Global phase equilibrium calculations: Critical lines, critical end points and liquid–liquid–vapour equilibrium in binary mixtures

التفاصيل البيبلوغرافية
العنوان: Global phase equilibrium calculations: Critical lines, critical end points and liquid–liquid–vapour equilibrium in binary mixtures
المؤلفون: Cismondi Duarte, Martín, Michelsen, Michael L.
بيانات النشر: Elsevier
المجموعة: CONICET Digital (Consejo Nacional de Investigaciones Científicas y Técnicas)
مصطلحات موضوعية: Calculation, Critical Lines, Critical End Points, Llv, Binary Mixtures, Eos, https://purl.org/becyt/ford/2.4Test, https://purl.org/becyt/ford/2Test
الوصف: A general strategy for global phase equilibrium calculations (GPEC) in binary mixtures is presented in this work along with specific methods for calculation of the different parts involved. A Newton procedure using composition, temperature and volume as independent variables is used for calculation of critical lines. Each calculated point is analysed for stability by means of the tangent plane distance, and the occurrence of an unstable point is used to determine a critical endpoint (CEP). The critical endpoint, in turn, is used as the starting point for constructing the three-phase line. The equations for the critical endpoint, as well as for points on the three-phase line, are also solved using Newton's method with temperature, molar volume and composition as the independent variables. The different calculations are integrated into a general procedure that allows us to automatically trace critical lines, critical endpoints and three-phase lines for binary mixtures with phase diagrams of types from I to V without advance knowledge of the type of phase diagram. The procedure requires a thermodynamic model in the form of a pressure-explicit EOS but is not specific to a particular equation of state. ; Fil: Cismondi Duarte, Martín. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Bahía Blanca. Planta Piloto de Ingeniería Química. Universidad Nacional del Sur. Planta Piloto de Ingeniería Química; Argentina ; Fil: Michelsen, Michael L. Technical University of Denmark; Dinamarca
نوع الوثيقة: article in journal/newspaper
وصف الملف: application/pdf
اللغة: English
تدمد: 0896-8446
العلاقة: info:eu-repo/semantics/altIdentifier/url/https://www.sciencedirect.com/science/article/pii/S0896844606000908Test#!; http://hdl.handle.net/11336/39013Test; Cismondi Duarte, Martín; Michelsen, Michael L.; Global phase equilibrium calculations: Critical lines, critical end points and liquid–liquid–vapour equilibrium in binary mixtures; Elsevier; Journal of Supercritical Fluids; 39; 3; 18-4-2006; 287-295; CONICET Digital; CONICET
الإتاحة: http://hdl.handle.net/11336/39013Test
حقوق: info:eu-repo/semantics/openAccess ; https://creativecommons.org/licenses/by-nc-sa/2.5/arTest/
رقم الانضمام: edsbas.7156A78D
قاعدة البيانات: BASE