Study on electrical conductive mechanism of mayenite derivative C12A7:C

Abstract

Abstract This study explains the conductive mechanism of C12A7:C from the perspective of crystal structure. C12A7:C is a carbon derivative of C12A7 and prepared by CaCO3 and Al2O3 in sealed graphite crucible through high-temperature sintering experiments. The main component was confirmed to be C12A7:C through X-ray diffraction inversion analysis. The four-probe method revealed that it is a semiconductor with conductivity of 4,339 S/m. A conductive model of C12A7:C crystal was established to study its conductive mechanism. Through theoretical calculations of the conductive structure model, the density of states and transfer function are important factors determining the conductivity of C12A7:C crystals. Based on the analysis of these two factors, C is the key to electron transfer in the C12A7:C crystal. Further research indicates that the C–C bond is the main form of C in C12A7:C crystals. These C–C bonds satisfy the formation conditions of conjugated systems and are key to the conductivity of C12A7:C crystals. Through simulation calculations, the volt ampere characteristic curve of C12A7:C exhibits Ohmic conductor characteristics. The conductivity of C12A7:C obtained through theoretical calculation is consistent with the experimental results. In conclusion, the conductivity of C12A7:C crystal is mainly due to the C–C conjugated system formed by carbon atoms in the crystal.