"Chemical Process Simulation" refers to the computer-aided modeling and analysis of chemical processes to predict the behavior of substances and reactions in a specific system. It involves using physical, chemical, and thermodynamic principles to simulate the progression of chemical reactions, mass transfers, and energy exchanges. These simulations aid engineers and scientists in optimizing process parameters, reducing costs, increasing efficiency, and minimizing risks.
Typical functions of software in the "Chemical Process Simulation" domain may include:
Modeling chemical reactions: Creating mathematical models that describe the behavior of chemicals during a reaction.
Substance transport analysis: Simulating the transport of substances through the system, including diffusion, convection, and mass transfer.
Thermodynamic calculations: Calculating thermodynamic properties such as pressure, temperature, and phase equilibrium.
Process optimization: Identifying optimal process parameters to maximize yield, minimize by-products, or save energy.
Plant and equipment design: Sizing and designing plant components such as reactors, separation devices, and heat exchangers based on simulation results.