PHASE-EQUILIBRIUM CALCULATIONS - WHAT IS EASY AND WHAT IS DIFFICULT

被引:67
作者
MICHELSEN, ML
机构
[1] Institut for Kemiteknik, Bygning 229, Danmarks Tekniske Højskole, DK-2800, Lyngby
关键词
D O I
10.1016/0098-1354(93)80034-K
中图分类号
TP39 [计算机的应用];
学科分类号
081203 ; 0835 ;
摘要
Calculation of phase equilibrium for a mixture of given composition requires specification of two process variables, typically chosen from among the following: temperature, pressure, vapour fraction, enthalpy, entropy or volume. The difficulties associated with solving the equilibrium equations are strongly related to the chosen selection of these process variables. The aim of the present paper is to outline the characteristics associated with the different types of specification in order to provide guidlines for efficient and robust solution algorithms.
引用
收藏
页码:431 / 439
页数:9
相关论文
共 15 条
[1]   VERSATILE ALGORITHM FOR CALCULATING VAPOR-LIQUID-EQUILIBRIA [J].
ASSELINEAU, L ;
BOGDANIC, G ;
VIDAL, J .
FLUID PHASE EQUILIBRIA, 1979, 3 (04) :273-290
[2]   GIBBS ENERGY ANALYSIS OF PHASE-EQUILIBRIA [J].
BAKER, LE ;
PIERCE, AC ;
LUKS, KD .
SOCIETY OF PETROLEUM ENGINEERS JOURNAL, 1982, 22 (05) :731-742
[3]   CONVERGENCE PROMOTION IN SIMULATION OF CHEMICAL PROCESSES - GENERAL DOMINANT EIGENVALUE METHOD [J].
CROWE, CM ;
NISHIO, M .
AICHE JOURNAL, 1975, 21 (03) :528-533
[4]   NUMERICAL ASPECTS OF THE IMPLEMENTATION OF CUBIC EQUATIONS OF STATE IN FLASH CALCULATION ROUTINES [J].
GUNDERSEN, T .
COMPUTERS & CHEMICAL ENGINEERING, 1982, 6 (03) :245-255
[5]   THE CALCULATION OF CRITICAL-POINTS [J].
HEIDEMANN, RA ;
KHALIL, AM .
AICHE JOURNAL, 1980, 26 (05) :769-779
[6]   SOLUTION OF NONLINEAR BOUNDARY-VALUE PROBLEMS .5A. NOVEL METHOD - GENERAL PARAMETER MAPPING (GPM) [J].
KUBICEK, M ;
HLAVACEK, V .
CHEMICAL ENGINEERING SCIENCE, 1972, 27 (04) :743-&
[7]   THE ISOTHERMAL FLASH PROBLEM .1. STABILITY [J].
MICHELSEN, ML .
FLUID PHASE EQUILIBRIA, 1982, 9 (01) :1-19
[8]   CALCULATION OF PHASE ENVELOPES AND CRITICAL-POINTS FOR MULTICOMPONENT MIXTURES [J].
MICHELSEN, ML .
FLUID PHASE EQUILIBRIA, 1980, 4 (1-2) :1-10
[9]   CALCULATION OF CRITICAL-POINTS AND PHASE BOUNDARIES IN THE CRITICAL REGION [J].
MICHELSEN, ML .
FLUID PHASE EQUILIBRIA, 1984, 16 (01) :57-76
[10]   MULTIPHASE ISENTHALPIC AND ISENTROPIC FLASH ALGORITHMS [J].
MICHELSEN, ML .
FLUID PHASE EQUILIBRIA, 1987, 33 (1-2) :13-27