Work package · Analysis02Process modeling & simulation

Process modeling and simulation that answers the engineering decision.

Fit-for-purpose process and reactor models that clarify performance, operating limits, uncertainty, and the data needed for the next stage.

Defined inputs · review points · issued outputs
Typical stageFeasibility · FEL · optimization
Primary inputsData · assumptions · objectives
Primary outputsModels · balances · sensitivities
Common interfacesR&D · engineering · management
01 · Purpose

Use modeling to resolve the question that controls the next decision.

A process model should do more than reproduce a flowsheet. It should expose the assumptions, interactions, sensitivities, and data gaps that determine whether a process can meet its technical and commercial objectives.

ONB develops fit-for-purpose models ranging from early feasibility calculations to integrated steady-state flowsheets, reactor models, digital twins, and targeted CFD or CPFD studies. Model complexity is matched to the decision and the quality of available data.

02 · Decision questions

Can the process meet its target?

Evaluate yield, purity, conversion, throughput, energy use, and operating constraints.

What drives performance?

Separate critical variables from secondary variables through sensitivity and scenario analysis.

What evidence is missing?

Identify the parameters and experiments that most reduce uncertainty before scale-up.

Where are the bottlenecks?

Locate capacity, separation, utility, heat-integration, and reactor-performance constraints.

03 · Scope & capabilities

Integrated process simulation

Aspen Plus, Aspen HYSYS, and other fit-for-purpose flowsheets; thermodynamic-method selection; recycles; utilities; and separation systems.

Reactor and kinetics models

Reaction networks, rate expressions, parameter estimation, residence-time effects, and reactor-performance calculations.

Sensitivity and uncertainty

Operating windows, scenario analysis, parameter ranges, uncertainty propagation, and decision-relevant tradeoffs.

Digital twins and model reduction

Models for design studies, monitoring, optimization, or integration with broader decision tools.

CFD and CPFD studies

Study definition and analysis for flow, heat and mass transfer, multiphase behavior, and reactor hydrodynamics.

Model review and validation

Independent audit of assumptions, inputs, convergence, calibration, validation evidence, and intended model use.

04 · Typical deliverables
Documented model files and calculation basis
Thermodynamic and reaction-method rationale
Mass and energy balances
Key assumptions and data-quality assessment
Sensitivity and scenario results
Operating-window or bottleneck analysis
Validation comparison and residual gaps
Recommended tests or next modeling steps
05 · Engineering principle

A model is only as useful as its assumptions.

ONB documents where inputs come from, which assumptions control the result, what has been validated, and where the model should not be relied upon. The result is reviewable by engineering, management, investors, vendors, and future project teams.

06 · Representative applications
Gasification and syngas systemsPyrolysisFischer–TropschHydrogen productionCCUS / CCUMultiphase reactorsSpecialty chemicalsSeparation systemsHeat integrationPlant optimization
07 · Frequently asked questions
Does every project require a full process-simulation model?
No. The appropriate tool may be a structured calculation, reactor model, spreadsheet, flowsheet, CFD study, or combination. The model should be no more complex than the decision requires.
Can ONB work with incomplete laboratory data?
Yes, provided uncertainty is made explicit. Early-stage work often uses bounded assumptions and sensitivity analysis to identify which missing data materially affect the decision.
Can an existing model be reviewed instead of rebuilt?
Yes. ONB can audit inputs, thermodynamics, reaction basis, convergence, validation, and suitability for intended use.
Will the client receive the model files?
Ownership and file transfer can be defined in the scope. ONB’s standard approach is to make deliverables usable and traceable for the client.
Start with the scope

What decision, drawing, model, or study does the project need next?