The reaction is:
The reaction is an exothermic equilibrium reaction in which the gas volume is reduced. The equilibrium constant K of the reaction (see table) and obtained from:
Since the reaction is exothermic, the equilibrium of the reaction shifts at lower temperatures to the ammonia side. Furthermore, four volumetric units of the raw materials produce two volumetric units of ammonia. According to Le Chatelier's principle, higher pressure favours ammonia. High pressure is necessary to ensure sufficient surface coverage of the catalyst with nitrogen. For this reason, a ratio of nitrogen to hydrogen of 1 to 3, a pressure of 250 to 350 bar, a temperature of 450 to 550 °C and α iron are optimal.
The catalyst ferrite (α-Fe) is produced in the reactor by the reduction of magnetite with hydrogen. The catalyst has its highest efficiency at temperatures of about 400 to 500 °C. Even though the catalyst greatly lowers the activation energy for the cleavage of the triple bond of the nitrogen molecule, high temperatures are still required for an appropriate reaction rate. At the industrially used reaction temperature of 450 to 550 °C an optimum between the decomposition of ammonia into the starting materials and the effectiveness of the catalyst is achieved. The formed ammonia is continuously removed from the system. The volume fraction of ammonia in the gas mixture is about 20%.
The inert components, especially the noble gases such as argon, should not exceed a certain content in order not to reduce the partial pressure of the reactants too much. To remove the inert gas components, part of the gas is removed and the argon is separated in a gas separation plant. The extraction of pure argon from the circulating gas is carried out using the Linde process.