• GLOPEQ

  • Referenced in 15 articles [sw07709]
  • computational tool for the phase and chemical equilibrium problem. Calculation of phase and chemical equilibrium ... this work, the goal is to obtain equilibrium solutions corresponding to a global minimum ... GLobal OPtimization for the Phase and chemical EQuilibrium problem) can guarantee global solutions for problems...
  • STANJAN

  • Referenced in 19 articles [sw13336]
  • element potential method for chemical equilibrium analysis: Implementation in the interactive program STANJAN...
  • EURANUS

  • Referenced in 9 articles [sw04088]
  • either perfect gases or air in chemical equilibrium. Closure of the Reynolds stresses is provided...
  • MT3DMS

  • Referenced in 22 articles [sw08693]
  • advection, dispersion, diffusion, and some chemical reactions including equilibrium-controlled linear or non-linear sorption...
  • CORE2D

  • Referenced in 5 articles [sw07855]
  • REactive solute transport under both local chemical equilibrium and kinetic conditions. It can handle abiotic ... lake, and 6) Coupled thermo-hydro-chemical processes of compacted bentonite after FEBEX in situ...
  • TOUGHREACT

  • Referenced in 22 articles [sw07854]
  • TOUGHREACT is a numerical simulation program for chemically reactive non-isothermal flows of multiphase fluids ... under local equilibrium or kinetic rates. The gas phase can be chemically active. Precipitation...
  • FEniCS-Reaktoro

  • Referenced in 4 articles [sw40340]
  • finite element framework FEniCS and the chemical equilibrium solver Reaktoro...
  • MINEQL

  • Referenced in 2 articles [sw19063]
  • general approach to the chemical equilibrium problem are described in Part I of the report ... description of the solution to the chemical equilibrium problem used in MINEQL appears in Appendix ... mathematical problem (without any reference to its chemical analog), followed by a very simple example ... concepts involved in the basic chemical equilibrium problem, (i.e., where there are no solid phases...
  • Reaktoro

  • Referenced in 2 articles [sw40343]
  • chemically reactive processes governed by either chemical equilibrium, chemical kinetics, or a combination of both...
  • FITEQL

  • Referenced in 3 articles [sw23342]
  • computer program for determination of chemical equilibrium constants from experimental data...
  • MICROQL

  • Referenced in 1 article [sw23341]
  • MICROQL: a chemical equilibrium program in BASIC. Computation of adsorption equilibria in BASIC. MICROQL ... multicomponent chemical equilibrium computer program. It is based on the version originally implemented ... program calculates chemical speciation in aqueous solution at thermodynamic equilibrium. The new version that ... step chemical entities, chemical species and chemical equilibrium systems. The generated chemical equilibrium systems...
  • ChemSage

  • Referenced in 2 articles [sw19061]
  • partial properties of its components. Chemical equilibrium calculations can be made for a system which...
  • libcgrpp

  • Referenced in 2 articles [sw07205]
  • hard global optimization problems, such as chemical equilibrium systems and robot kinematics applications (Hirsch...
  • SPECY

  • Referenced in 9 articles [sw02852]
  • method to linearise the equilibrium chemistry and respect of the chemically allowed interval and positive...
  • CXTFIT

  • Referenced in 5 articles [sw30614]
  • considered: (i) the conventional equilibrium ADE; (ii) the chemical and physical nonequilibrium ADEs ... tube model based upon the local-scale equilibrium or nonequilibrium...
  • GEMS3K

  • Referenced in 7 articles [sw19058]
  • relevant subsurface systems. Thermodynamic equilibrium defines the baseline for solubility, chemical kinetics...
  • TeDy

  • Referenced in 1 article [sw26679]
  • software package to compute the chemical-equilibrium composition in multicomponent multiphase systems, the changes ... thermodynamic functions of specific chemical reactions, the phase diagrams of multiphase systems, and to provide ... thermodynamics database. The function of the equilibrium computation is based on the stoichiometric method used ... Gibbs energy are used to determine the equilibrium material composition. The thermodynamic functions of specific...
  • WATEQF

  • Referenced in 1 article [sw36799]
  • WATEQ : a computer program for calculating chemical equilibrium of natural waters. WATEQF is a FORTRAN...
  • GEMSFIT

  • Referenced in 1 article [sw25636]
  • thermodynamic fitting tool coupled to a chemical equilibrium solver which uses the direct Gibbs energy...