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arxiv: 0805.3894 · v1 · submitted 2008-05-26 · ❄️ cond-mat.supr-con · cond-mat.mtrl-sci

High T_c superconductivity in superhard diamond-like BC₅

classification ❄️ cond-mat.supr-con cond-mat.mtrl-sci
keywords alphadiamond-likesuperconductivitysuperhardatomaveragecalculationscoefficients
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Using density functional theory calculations we show that the recently-synthesized, superhard diamond-like BC$_5$ is superconducting with a critical temperature of the same order than that of MgB$_2$. The average electron-phonon coupling is $\lambda=0.89$, the phonon-frequency logarithmic-average is $<\omega >_{\log}=67.4 $ meV and the isotope coefficients are $\alpha(C)=0.3$ and $\alpha(B)=0.2$. In BC$_5$, superconductivity is mostly sustained by vibrations of the B atom and its C neighbors.

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