2022
DOI: 10.1039/d2cp02403a
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Superconductivity and topological states in hexagonal TaC and NbC

Abstract: Materials with superconductivity and nontrivial band structure near the Fermi level are promising candidates in realizing topological superconductivity. Using first-principles calculations, we systematically investigated the stability, mechanical properties, superconductivity, electronic...

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Cited by 2 publications
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“…The literature reports that rocksalt NbC has T c 's of 9 -11 K for bulk phases [68][69][70][71] and 8 -11.5 K for thin films, [72,73] while rocksalt Nb x Zr 1 − x C, or Zr doping in NbC, reduces the T c . [74] However, DFT (density functional theory) simulations suggest that rocksalt and hexagonal NbC may have T c 's as high as 15.7 [75] and 17.1 K, [76] respectively. Also, DFT simulations on the complex NbC 1 − x N x , or nitrogen doping in rocksalt NbC, predict T c 's ranging from 11.2 to 23.1 K, [77] suggesting that the effect of multiple light impurities on the T c is not yet fully understood.…”
Section: Composition Analysis and Open Discussion On The Active Phase...mentioning
confidence: 99%
“…The literature reports that rocksalt NbC has T c 's of 9 -11 K for bulk phases [68][69][70][71] and 8 -11.5 K for thin films, [72,73] while rocksalt Nb x Zr 1 − x C, or Zr doping in NbC, reduces the T c . [74] However, DFT (density functional theory) simulations suggest that rocksalt and hexagonal NbC may have T c 's as high as 15.7 [75] and 17.1 K, [76] respectively. Also, DFT simulations on the complex NbC 1 − x N x , or nitrogen doping in rocksalt NbC, predict T c 's ranging from 11.2 to 23.1 K, [77] suggesting that the effect of multiple light impurities on the T c is not yet fully understood.…”
Section: Composition Analysis and Open Discussion On The Active Phase...mentioning
confidence: 99%