799 research outputs found
Effect of spin fluctuations on Tc from density-functional theory for superconductors
The transverse spin fluctuations are introduced to the density functional
theory for superconductors (SCDFT). Paramagnons are treated within the random
phase approximation and assumed to be the same for the normal and
superconducting state. The effect of spin fluctuations on Tc is studied for a
few simple metals at ambient pressure and niobium at several pressures up to 80
GPa.Comment: 11 pages, 2 tables, 2 figure
Effect of C-face 4H-SiC(0001) deposition on thermopower of single and multilayer graphene in AA, AB and ABC stacking
The Seebeck coefficient in multilayer graphene is investigated within the
density-functional theory, using the semiclassical Boltzmann equations and
interpolating the bands in a maximally-localized Wannier functions basis set.
We compare various graphene stackings (AA, AB and ABC) both free-standing and
deposited on a -SiC(0001) C-terminated substrate. We find that the presence
of the SiC substrate can significantly affect the thermopower properties of
graphene layers, depending on the stacking, providing a promising way to tailor
efficient graphene-based devices.Comment: 7 pages, 4 figure
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