Where to find lossless metals?

Hypothetical metals having optical absorption losses as low as those of the transparent insulators, if found, could revolutionize optoelectronics. We perform the first high-throughput search for lossless metals among all known inorganic materials in the databases of over 100,000 entries. The 381 can...

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Veröffentlicht in:arXiv.org 2022-04
Hauptverfasser: Hu, Xiaolei, Wu, Zhengran, Li, Zhilin, Xu, Qiunan, Chen, Kun, Jin, Kui, Weng, Hongming, Lu, Ling
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Sprache:eng
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Zusammenfassung:Hypothetical metals having optical absorption losses as low as those of the transparent insulators, if found, could revolutionize optoelectronics. We perform the first high-throughput search for lossless metals among all known inorganic materials in the databases of over 100,000 entries. The 381 candidates are identified -- having well-isolated partially-filled bands -- and are analyzed by defining the figures of merit and classifying their real-space conductive connectivity. The existing experimental evidence of most candidates being insulating, instead of conducting, is due to the limitation of current density functional theory in predicting narrow-band metals that are unstable against magnetism, structural distortion, or electron-electron interactions. We propose future research directions including conductive oxides, intercalating layered materials, and compressing these false-metal candidates under high pressures into eventual lossless metals.
ISSN:2331-8422