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- W4281941569 abstract "Using first-principles calculations, we predict the two-dimensional (2D) monolayer boron-nitrogen compound ${mathrm{B}}_{3}mathrm{N}$, which shows a honeycomb lattice similar to graphene. Its stability is proved by phonon spectra and ab initio molecular dynamics simulations. Since pristine ${mathrm{B}}_{3}mathrm{N}$ is a metal by band structure calculation, we investigate the electron-phonon coupling and possible phonon-mediated superconductivity. Based on the Eliashberg equation, the calculated electron-phonon coupling strength is about 0.66, and the superconducting transition temperature ${T}_{c}$ is 14.1 K, which is comparable to that of borophene. Furthermore, when 0.04 electron/cell doping and 10% biaxial tensile strain are applied, ${T}_{c}$ can be increased to 17.4 K. Thus, the predicted ${mathrm{B}}_{3}mathrm{N}$ provides a platform for 2D superconductivity." @default.
- W4281941569 created "2022-06-13" @default.
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- W4281941569 date "2022-06-01" @default.
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- W4281941569 title "Theoretical prediction of superconductivity in monolayer <mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML><mml:msub><mml:mi mathvariant=normal>B</mml:mi><mml:mn>3</mml:mn></mml:msub><mml:mi mathvariant=normal>N</mml:mi></mml:math>" @default.
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- W4281941569 doi "https://doi.org/10.1103/physrevb.105.224501" @default.
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