Difference between revisions of "orch:Solvers"
From orch
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== Solver to build reference trajectories == | == Solver to build reference trajectories == | ||
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| + | == DRGEP solver for species reduction == | ||
* Compute species direct inter-relations | * Compute species direct inter-relations | ||
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* Compute species relations through indirect paths | * Compute species relations through indirect paths | ||
| − | * Compute relations between targets and | + | * Compute relations between targets and |
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== DRGEP solver for reactions reduction == | == DRGEP solver for reactions reduction == | ||
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* Solve for thermodynamic | * Solve for thermodynamic | ||
| − | + | <math>h_k = \Delta h_{f,k}^{0} + h_{sk}</math> | |
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| − | \ | + | <math>h_{sk} = \int_{T_0}^{T} Cp_k dT</math> |
Get Gibbs Free Energy | Get Gibbs Free Energy | ||
Get Equilibrium constants | Get Equilibrium constants | ||
Latest revision as of 19:33, 7 March 2016
Contents
Solver to build reference trajectories
DRGEP solver for species reduction
- Compute species direct inter-relations
- Compute species relations through indirect paths
- Compute relations between targets and
DRGEP solver for reactions reduction
QSS solver
- Solve for thermodynamic
Get Gibbs Free Energy
Get Equilibrium constants
