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Ab initio theory of eliminating surface oxides of superconductors with noble-metal encapsulation

Cristóbal Méndez, Nathan Sitaraman, Matthias Liepe, Tomás A. Arias

DOI 10.1103/l5jh-sldp · Physical Review Applied

T1

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Abstract

Nanometer-scale surface chemistry limits the performance of superconducting radio-frequency cavities and quantum circuits. We present an ab initio framework connecting density-functional theory interfacial energetics with strong-coupling Eliashberg theory for capped Nb and Ta surfaces. This approach identifies Au and Au-based alloys (AuPd, AuPt) as effective passivation layers. Our model further predicts that combining a noble-metal capping layer with an appropriate wetting/adhesion layer yields far more robust adhesion than a capping layer alone under realistic conditions, enabling thinner caps and thus addressing a central challenge in superconducting surface passivation.

Source-reported materials — not catalogue approval

FormulaReported Tc (K)Pressure (GPa)Type
Nb

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—Pressure not reportedunknown
Ta

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Source-occurrence policy only; no material identity or catalogue acceptance is inferred from the formula.

—Pressure not reportedunknown

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