| Literature DB >> 14683147 |
D Connétable1, V Timoshevskii, B Masenelli, J Beille, J Marcus, B Barbara, A M Saitta, G-M Rignanese, P Mélinon, S Yamanaka, X Blase.
Abstract
We present a joint experimental and theoretical study of the superconductivity in doped silicon clathrates. The critical temperature in Ba(8)@Si-46 is shown to strongly decrease with applied pressure. These results are corroborated by ab initio calculations using MacMillan's formulation of the BCS theory with the electron-phonon coupling constant lambda calculated from perturbative density functional theory. Further, the study of I(8)@Si-46 and of gedanken pure silicon diamond and clathrate phases doped within a rigid-band approach show that the superconductivity is an intrinsic property of the sp(3) silicon network. As a consequence, carbon clathrates are predicted to yield large critical temperatures with an effective electron-phonon interaction much larger than in C60.Entities:
Year: 2003 PMID: 14683147 DOI: 10.1103/PhysRevLett.91.247001
Source DB: PubMed Journal: Phys Rev Lett ISSN: 0031-9007 Impact factor: 9.161