Introduction to Air Quality Modeling: Photochemical Modeling

Photochemical modeling is the central element of the air quality modeling process. A photochemical grid model is used to calculate pollutant concentrations.

The Role of a Photochemical Grid Model in Air Quality Modeling

A photochemical grid model is used to:

  • assess how sensitive pollutant concentrations are to changes in various parameters including pollution emissions, meteorological conditions, and initial and boundary conditions;

  • assess the sensitivity of pollutant predictions to various control scenarios (individual controls and combined controls); and

  • determine whether various control scenarios actually result in predicted attainment or achievement of target concentrations.

How Does a Photochemical Grid Model Work?

A photochemical grid model is a computer model designed for simulating air pollution episodes.

Air pollution scientists can investigate the causes of air pollution with measurements of the ambient air. These measurements are useful for determining how serious the air pollution problems are, and how they occur. But in order to determine how to alleviate complex air pollution problems, scientists need a tool that can allow them to run experiments that test different strategies for controlling air pollution. Currently, the most effective way of testing control strategies is a type of computer model called a photochemical grid model.

Photochemical grid models are intended to accurately depict the ways in which air pollution forms, accumulates, and dissipates. They accomplish this by simulating the processes within a city that are most important in generating ozone pollution. For example, photochemical grid models are driven by meteorological models, similar to those used for weather forecasting, so that the winds that carry pollutants around the city are accurately simulated. Another example is the emissions from industrial sources, cars and trucks, locomotives, ships, and the many other sources that emit chemicals which can participate in ozone formation. A third example is the chemistry: photochemical grid models simulate the chemical reactions that can result in formation of ozone. The models are called "photochemical" because they can simulate the destruction of chemicals by sunlight. The fragments of these chemicals can react with volatile organic compounds and nitrogen oxides, which can eventually lead to ozone formation.

A photochemical grid model simulates the atmosphere above a city by dividing it into thousands of boxes, or individual grid cells. These grid cells are typically a few kilometers wide (e.g., 4 kilometers by 4 kilometers). The vertical thickness of the cells varies, with the shortest cells near the ground, and thicker cells at the higher levels of the atmosphere. The model calculates concentrations of pollutants, such as ozone, in each cell by simulating

  • movement of air into and out of cells (advection and dispersion);

  • mixture of pollutants upward and downward among layers;

  • injection of new emissions from sources such as point, area, mobile, and biogenic into each cell; and

  • chemical reactions based on chemical equations, pollution precursors, and incoming solar radiation in each cell.

Major Photochemical Models

Following are major photochemical models used by the air quality modeling community: