Ontology highlight
ABSTRACT:
SUBMITTER: Kuganathan N
PROVIDER: S-EPMC6416248 | biostudies-literature | 2019 Mar
REPOSITORIES: biostudies-literature
Scientific reports 20190313 1
Magnesium titanate is technologically important due to its excellent dielectric properties required in wireless communication system. Using atomistic simulation based on the classical pair potentials we study the defect chemistry, Mg and O diffusion and a variety of dopant incorporation at Mg and Ti sites. The defect calculations suggest that cation anti-site defect is the most favourable defect process. The Mg Frenkel is the second most favourable intrinsic defect though the formation energy is ...[more]