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- W3100970688 abstract "CaOFeS is a semiconducting oxysulfide with polar layered triangular structure. Here a comprehensive theoretical study has been performed to reveal its physical properties, including magnetism, electronic structure, phase transition, magnetodielectric effect, as well as optical absorption. Our calculations confirm the Ising-like G-type antiferromagnetic ground state driven by the next-nearest neighbor exchanges, which breaks the trigonal symmetry and is responsible for the magnetodielectric effect driven by exchange striction. In addition, a large coefficient of visible light absorption is predicted, which leads to promising photovoltaic effect with the maximum light-to-electricity energy conversion efficiency up to 24.2%." @default.
- W3100970688 created "2020-11-23" @default.
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- W3100970688 date "2017-08-30" @default.
- W3100970688 modified "2023-10-03" @default.
- W3100970688 title "Exchange striction driven magnetodielectric effect and potential photovoltaic effect in polar CaOFeS" @default.
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- W3100970688 doi "https://doi.org/10.1103/physrevmaterials.1.034406" @default.
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