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Ab initio calculation of the voltage profile for LiC6

Author: Kganyago, KR ; Ngoepe, PE ; Catlow, CRA Date: Mar 2003 Energetics of the anode system LiC6 compared to metallic lithium is calculated within the framework of local-density functional theory (LDA-DFT) techniques. Our results suggest that the energy of anode intercalation results in a small change ... Read more
Structural and electronic properties of lithium intercalated graphite LiC6

Author: Kganyago, KR ; Ngoepe, PE Date: Nov 2003 The lattice properties and electronic structure of graphite and LiC6 within the most widely used density-functional theory implementation, the local density approximation (LDA) are calculated. Improvements to the LDA in the form of a generalized ... Read more

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Browsing by Subject "LiC6"

Browsing by Subject "LiC6"

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