A theoretical study of the electronic and optical properties of the graphite intercalation compound K(NH3)(4)C-24

The electronic properties of the ternary potassium-ammonia graphite intercalation compound K(NH3)4C24 are studied using generalized gradient-corrected density functional theory, following recent theoretical and experimental studies on the microscopic structure and dynamics of intercalation compounds...

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Bibliographic Details
Main Authors: Bernasconi, L, Madden, P
Format: Journal article
Language:English
Published: 2002