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Structural phase transition and superconductivity of ytterbium under high pressure

Qingzhuo Duan, Junyu Shen, Xin Zhong, Haiyan Lu, Cheng Lu

DOI 10.1103/PhysRevB.105.214503 · Physical Review B

T1

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Abstract

Recent advances in theory and experiment declare the rare-earth (RE) hydrogen-rich compound LaH10 is a near room-temperature superconductor under high pressure. To understand the underlying mechanism of superconductivity and explore the crucial role of lanthanides in forming the RE-based polyhydrides, we here perform a theoretical study on the structural phase transition and superconductivity of late lanthanide ytterbium (Yb) metal under high pressure up to 240 GPa. Two alternative structures, R3¯m and I4/mmm phases, of Yb are presented. Most interestingly, the P63/mmc phase of Yb is serendipitously discovered to be a superior superconductor with a critical temperature value of 19.5 K at 160 GPa, which is higher than other known RE elemental superconductors. The present findings establish an alternative structural phase transition sequence of Yb, which offers insights for further understanding the vital physics mechanisms of a lanthanide-based superconductor.

Source-reported materials — not catalogue approval

FormulaReported Tc (K)Pressure (GPa)Type
LaH10

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280210 GPaunknown
LaH10

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250150 GPaunknown
Nb

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9.9Pressure not reportedunknown
Tc

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8.2Pressure not reportedunknown
Ta

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4.5Pressure not reportedunknown
Fe

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2.1Pressure not reportedunknown
Yb

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1.486 GPaunknown
Yb

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4.6179 GPaunknown
Yb

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19.5160 GPaunknown

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