Complex Equilibrium Calculations of Nonideal Multiphase Systems (CEC- NMS) and Applications to Liquid Metal Fuel Combustion

Abstract

This technical report summarizes a new chemical equilibrium computer code developed for general reacting systems, and presents equilibrium results for several reacting pairs in liquid metal fuel combustion. Specifically, the object of this report is to develop a general computer code for calculating complex chemical equilibrium of nonideal, multiphase, electrolytic mixtures. The necessary thermodynamic potentials which describe the equilibrium state of a system are developed from the fundamental relation using Legendre transforms. For a system at a given temperature and pressure, the Gibbs' potential function reaches a minimum value at equilibrium. The minimization of this function, subject to element and charge conservation constraints, is viewed as a constrained optimization problem, which is solved by the method of Lagrangian multipliers. Liquid metals.

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Document Details

Document Type
Technical Report
Publication Date
Mar 15, 1989
Accession Number
ADA209990

Entities

People

  • P. J. Janke
  • Stanley H. Chan

Organizations

  • University of Wisconsin Madison Department of Mechanical Engineering

Tags

Communities of Interest

  • Energy and Power Technologies
  • Ground and Sea Platforms
  • Weapons Technologies

DTIC Thesaurus Topics

  • Chemical Elements
  • Chemical Equilibrium
  • Chemical Reactions
  • Chemistry
  • Combustion
  • Computational Science
  • Computer Programs
  • Computers
  • Electrolytes
  • Equations
  • Equations Of State
  • Heat Energy
  • Ideal Gas Law
  • Liquid Phases
  • Mechanical Engineering
  • Thermodynamic Properties
  • Thermodynamics

Fields of Study

  • Chemistry

Readers

  • Combustion science or combustion engineering.
  • Operations Research