The family of LiCo 6 P 4 type compounds-trends in electronic structure and chemical bonding

Abstract

Selected ternary compounds of the family of AT6X4 (LiCo6P4-type) intermetallics have been studied by ab initio methods with respect to their electronic structures and chemical bonding. The bonding characteristics highlight the role of the three-dimensional [T6X4] polyanionic networks which, within the hexagonal channels, accommodate loosely bonded A cations… (More)

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