Ontology highlight
ABSTRACT:
SUBMITTER: Ma J
PROVIDER: S-EPMC8055897 | biostudies-literature | 2021 Apr
REPOSITORIES: biostudies-literature
Nature communications 20210419 1
We use first-principles methods to study doped strong ferroelectrics (taking BaTiO<sub>3</sub> as a prototype). Here, we find a strong coupling between itinerant electrons and soft polar phonons in doped BaTiO<sub>3</sub>, contrary to Anderson/Blount's weakly coupled electron mechanism for "ferroelectric-like metals". As a consequence, across a polar-to-centrosymmetric phase transition in doped BaTiO<sub>3</sub>, the total electron-phonon coupling is increased to about 0.6 around the critical co ...[more]