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  Interplay between structure and superconductivity: Metastable phases of phosphorus under pressure

Flores-Livas, J. A., Sanna, A., Drozdov, A. P., Boeri, L., Profeta, G., Eremets, M. I., et al. (2017). Interplay between structure and superconductivity: Metastable phases of phosphorus under pressure. Physical Review Materials, 1(2): 024802. doi:10.1103/PhysRevMaterials.1.024802.

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 Urheber:
Flores-Livas, Jose A.1, Autor
Sanna, Antonio1, Autor
Drozdov, A. P.2, Autor           
Boeri, Lilia1, Autor
Profeta, Gianni1, Autor
Eremets, M. I.2, Autor           
Goedecker, Stefan1, Autor
Affiliations:
1external, ou_persistent22              
2High Pressure Group, Max Planck Institute for Chemistry, Max Planck Society, ou_1826289              

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 Zusammenfassung: Pressure-induced superconductivity and structural phase transitions in phosphorus (P) are studied by resistivity measurements under pressures up to 170 GPa and by fully ab initio crystal structure exploration and superconductivity calculations up to 350 GPa. Two distinct superconducting transition temperature ( T C )vs pressure ( P ) trends at low pressure have been reported more than 30 years ago, and we are able to devise a consistent explanation founded on thermodynamically metastable phases of black phosphorus. Our experimental and theoretical results form a single, consistent picture which not only provides a clear understanding of elemental P under pressure but also sheds light on the longstanding and unsolved anomalous superconductivity trends. Moreover, at higher pressures we predict a similar scenario of multiple metastable structures which coexist beyond their thermodynamical stability range. We observe that all the metastable structures systematically exhibit larger transition temperatures than the ground-state structures, indicating that the exploration of metastable phases represents a promising route to design materials with improved superconducting properties.

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Sprache(n): eng - English
 Datum: 2017
 Publikationsstatus: Online veröffentlicht
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 Ort, Verlag, Ausgabe: -
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Titel: Physical Review Materials
  Kurztitel : Phys. Rev. Mat.
Genre der Quelle: Zeitschrift
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Ort, Verlag, Ausgabe: College Park, MD : American Physical Society
Seiten: - Band / Heft: 1 (2) Artikelnummer: 024802 Start- / Endseite: - Identifikator: ISSN: 2475-9953
CoNE: https://pure.mpg.de/cone/journals/resource/2475-9953