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High-temperature multigap superconductivity in two-dimensional metal borides

Cem Sevik, Jonas Bekaert, Mikhail Petrov, Milorad V. Milošević

DOI 10.1103/PhysRevMaterials.6.024803 · Physical Review Materials

T1

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Abstract

Using first-principles calculations in combination with the Eliashberg formalism, we systematically investigated phonon-mediated superconductivity in two-dimensional (2D) metal-boride crystals, consisting of a boron honeycomb network doped by diverse metal elements. Such 2D metal-boride compounds, named MBenes, are chemically exfoliable from single-crystalline layered ternary borides. First we identified the MBene layers with potential for superconductivity via isotropic Eliashberg calculations, considering a wide range of metal elements, with a focus on alkaline earth and transition metals. Subsequently, we performed a detailed analysis of the prominent superconducting MBenes by solving the anisotropic Eliashberg equations. The obtained high critical temperatures (up to 72 K), as well as the rich multigap superconducting behavior, recommend these crystals for further use in multifunctional 2D heterostructures and superconducting device applications.

Source-reported materials — not catalogue approval

FormulaReported Tc (K)Pressure (GPa)Type
BeB4

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29.9Pressure not reportedunknown
MgB4

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22.2Pressure not reportedunknown
CaB4

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36.1Pressure not reportedunknown
ScB4

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10.4Pressure not reportedunknown
AlB4

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30.9Pressure not reportedunknown
MgB2

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11.6Pressure not reportedunknown
CaB2

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41.6Pressure not reportedunknown
ScB2

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20.4Pressure not reportedunknown
ZrB2

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2.9Pressure not reportedunknown
VB2

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8.3Pressure not reportedunknown
NbB2

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35.5Pressure not reportedunknown
TaB2

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7.1Pressure not reportedunknown
CrB2

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4.5Pressure not reportedunknown
ReB2

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2.4Pressure not reportedunknown
AlB2

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9.8Pressure not reportedunknown
Mg2B2

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3.2Pressure not reportedunknown
Re2B2

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5.5Pressure not reportedunknown
MgB2

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39Pressure unresolvedunknown
CaB2

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48Pressure not reportedunknown

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