화학공학소재연구정보센터
Computers & Chemical Engineering, Vol.24, No.2-7, 1215-1221, 2000
Reaction path synthesis for a mass closed-cycle system
With more and more severe problems of environmental pollution, the chemical industry entails the consideration of minimum environmental impact when synthesizing reaction path. In this paper, a systematic method for reaction path synthesis is described in which undesirable chemicals are cycled to realize zero avoidable pollution. A novel concept of simple stoichiometric reactions (SSRs) is introduced to determine simple stoichiometries between raw materials, probable intermediate chemicals and co-products and to form a reaction path network. Promising reactions are identified by an optimization program from this network. Case studies are discussed to illustrate the proposed method.