Electronic structure, electron-phonon in
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D.L. Novikov; V.A. Gubanov; A.J. Freeman
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Article
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1992
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Elsevier Science
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English
β 745 KB
Results of electronic structure calculations of C6o and M3C6o (M = K, Rb, Cs) fcc crystals carried out by the full-potentiallinear muffin-tin orbital (LMTO) method are reported. Undoped C6o is found to be semiconductir~g wtt:z a direct gap between the fully occupied valence band and empty conduction