This paper presents the research results of the effect of using calcium oxide and potassium permanganate on the combustion of pellets from wheat bran and beet pulp. The measurements were performed in the technical laboratory of the Centre of Energy Utilization of Non-Traditional Energy Sources in Ostrava. The research examined the effect of the use of chemical substances on the amount of air pollutants from biomass thermal conversion in a low-power boiler and the process temperature. First, we performed technical and elementary analyses of agricultural waste. The raw material was then comminuted, mixed with a selected additive, pelletized, and finally burned in a low-power boiler. The additive was added in three proportions: 1:20, 1:10, and 1:6.67 (i.e., 15%) relative to the fuel weight. The combustion process efficiency was measured using a flue gas analyzer and three thermocouples attached to the data recorder. From the measurement results, we were able to determine the percentage reduction of pollutant emissions into the atmosphere (CO, NO_x, and SO₂) due to the use of additives. Because emission standards are becoming increasingly stringent and fuel and energy prices are rising, the results presented in this article may be useful to agri-food processing plants that want to manage these materials thermally.

Dangerous gases arising from combustion processes must be removed from the air simply and cheaply, e.g., by adsorption. This work is focused on competitive adsorption experiments and force field-based molecular modeling of the interactions at the molecular level. Emission gas, containing CO, NO, SO₂, and CO₂, was adsorbed on activated carbon, clay mineral, silicon dioxide, cellulose, or polypropylene at two different temperatures. At 20 °C, activated carbon had the highest NO and SO₂ adsorption capacity (120.83 and 3549.61 μg/g, respectively). At 110 °C, the highest NO and SO₂ adsorption capacity (6.20 and 1182.46 μg/g, respectively) was observed for clay. CO was adsorbed very weakly, CO₂ not at all. SO₂ was adsorbed better than NO, which correlated with modeling results showing positive influence of carboxyl and hydroxyl functional groups on the adsorption. In addition to the wide range of adsorbents, the main novelty of this study is the modeling strategy enabling the simulation of surfaces with pores of controllable sizes and shapes, and the agreement of the results achieved by this strategy with the results obtained by more computationally demanding methods. Moreover, the agreement with experimental data shows the modeling strategy to be a valuable tool for further adsorption studies.