
Initiation of heterogeneous Schrock-type Mo and W oxide metathesis catalysts: A quantum thermochemical study
Keywords: اتیلن; Thermochemistry; Initiation; Mechanism; DFT; Tungsten; Molybdenum; Metathesis; Olefin; Ethylene; Propylene; Activation; Heterogeneous catalyst; Computational chemistry; Silica; Thermodynamics; Carbene; Schrock; Alkylidene; Molecular simulation;