Role of Water in Green Carbon Science

Within the context of green chemistry, the concept of green carbon science emphasizes carbon balance and recycling to address the challenge of achieving carbon neutrality. The fundamental processes in this field are oxidation and reduction, which often involve simple molecules such as CO2, CO, CH4, CHx, and H2O. Water plays a critical role in nearly all oxidation-reduction processes, and thus, it is a central focus of research in green carbon science. Water can act as a direct source of dihydrogen in reduction reactions or participate in oxidation reactions, frequently involving O-O coupling to produce hydrogen peroxide or dioxygen. At the atomic level, this coupling involves the statistically unfavorable proximity of two atoms, requiring optimization through a catalytic process influenced by two types of factors, as described by the authors. Extrinsic factors are related to geometrical and electronic criteria associated with the catalytic metal, involving its d-orbitals (or bands in the case of zerovalent metals and electrodes). Intrinsic factors are related to the coupling of oxygen atoms via their p-orbitals. At the mesoscopic or microscopic scale, the reaction medium typically consists of mixtures of lipophilic and hydrophilic phases with water, which may exist under supercritical conditions or as suspensions of microdroplets. These reactions predominantly occur at phase interfaces. A comprehensive understanding of the phenomena across these scales could facilitate improvements and even lead to the development of novel conversion processes.