Chemical and Phase Equilibria with Adsorption using Minimization of Gibbs Energy

被引:0
|
作者
Pacheco, K. A. [1 ]
Guirardello, R. [1 ]
机构
[1] Univ Estadual Campinas, Sch Chem Engn, Ave Albert Einstein 500, Campinas, SP, Brazil
关键词
Gibbs Energy Minimization; Thermodynamic Consistency Test; Adsorption Parameters; Fischer Tropsch; CATALYST;
D O I
10.1063/1.5044107
中图分类号
O29 [应用数学];
学科分类号
070104 ;
摘要
The synthesis of Fischer Tropsch is an important technology in gas-to-liquids conversion processes, which allows the conversion of synthesis gas into a mixture of hydrocarbons. The thermodynamic modeling of this system can be performed by chemical and phase equilibrium calculations, where the minimization of the Gibbs energy is the necessary condition for solving the problem. The addition of adsorption parameters were employed in the methodology to evaluate the influence of catalyst in the products. The presence of the catalyst and its quantity affects the mass balance of the system because more species may or may not adsorb on the surface of the solid.
引用
收藏
页数:4
相关论文
共 50 条
  • [1] On the calculation of ionic equilibria using the gibbs energy minimization method
    Petr Voňka
    Jindřich Leitner
    [J]. Metallurgical and Materials Transactions B, 1998, 29 : 1372 - 1374
  • [2] On the calculation of ionic equilibria using the Gibbs energy minimization method
    Vonka, P
    Leitner, J
    [J]. METALLURGICAL AND MATERIALS TRANSACTIONS B-PROCESS METALLURGY AND MATERIALS PROCESSING SCIENCE, 1998, 29 (06): : 1372 - 1374
  • [3] Calculation of constrained equilibria by Gibbs energy minimization
    Koukkari, P
    Pajarre, R
    [J]. CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY, 2006, 30 (01): : 18 - 26
  • [4] Extrapolation of thermodynamic functions in calculation of phase equilibria by the Gibbs energy minimization method
    Bychinskii, V. A.
    Tupitsyn, A. A.
    Chudnenko, K. V.
    Mukhetdinova, A. V.
    Fomichev, S. V.
    Krenev, V. A.
    [J]. RUSSIAN JOURNAL OF INORGANIC CHEMISTRY, 2013, 58 (10) : 1197 - 1202
  • [5] Extrapolation of thermodynamic functions in calculation of phase equilibria by the Gibbs energy minimization method
    V. A. Bychinskii
    A. A. Tupitsyn
    K. V. Chudnenko
    A. V. Mukhetdinova
    S. V. Fomichev
    V. A. Krenev
    [J]. Russian Journal of Inorganic Chemistry, 2013, 58 : 1197 - 1202
  • [6] Gibbs free energy minimization for the calculation of chemical and phase equilibrium using linear programming
    Rossi, C. C. R. S.
    Cardozo-Filho, L.
    Guirardello, R.
    [J]. FLUID PHASE EQUILIBRIA, 2009, 278 (1-2) : 117 - 128
  • [7] A Gibbs energy minimization method for constrained and partial equilibria
    Koukkari, Pertti
    Pajarre, Risto
    [J]. PURE AND APPLIED CHEMISTRY, 2011, 83 (06) : 1243 - 1254
  • [8] Unconstrained Gibbs Minimization for Solving Multireaction Chemical Equilibria Using a Stochastic Global Optimizer
    Fateen, Seif-Eddeen K.
    [J]. COMPUTER APPLICATIONS IN ENGINEERING EDUCATION, 2016, 24 (06) : 899 - 904
  • [9] Chemical Equilibrium by Gibbs Energy Minimization on Spreadsheets
    Lwin, Y.
    [J]. INTERNATIONAL JOURNAL OF ENGINEERING EDUCATION, 2000, 16 (04) : 335 - 339
  • [10] Computation of complex and constrained equilibria by minimization of the Gibbs free energy
    Neron, A.
    Lantagne, G.
    Marcos, B.
    [J]. CHEMICAL ENGINEERING SCIENCE, 2012, 82 : 260 - 271