Physics – Condensed Matter – Superconductivity
Scientific paper
2002-01-09
Solid State Commun. 124, 25-28 (2002)
Physics
Condensed Matter
Superconductivity
4 pages, 5 figures
Scientific paper
10.1016/S0038-1098(02)00454-4
Using density-functional-based methods, we show that the hole-doped Li_{x}BC and Na_{x}BC in P6_{3}/mmc crystal structure and C_{x} in graphite structure are capable of showing superconductivity, possibly with a T_{c} much higher than that of MgB_{2}. We use full-potential methods to obtain the optimized lattice constants a and c, coherent-potential approximation to describe the effects of disorder, Gaspari-Gyorffy formalism to obtain the electron-phonon coupling constant $\lambda$, and Allen-Dynes equation to calculate T_{c} as a function of hole concentration in these alloys.
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