The interplay between the structural and magnetic properties of vanadium dioxide from first principles

The effects of the spin and lattice degrees of freedom on the electronic structure of M1 vanadium dioxide are explored using a quasiparticle description. Contraction of the inter-vanadium spacing of the Peierls pairings stabilizes bonding electrons, reducing polarizability and thus widening the band...

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Bibliographische Detailangaben
Hauptverfasser: Booth, Jamie, Drumm, Daniel, Casey, Phil, Smith, Jackson, Russo, Salvy
Format: Artikel
Sprache:eng
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