Possible spin-density wave on Fermi arc of edge state in single-component molecular conductors [Pt(dmdt)$_2$] and [Ni(dmdt)$_2$]

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Abstract:

We construct three-orbital tight-binding models describing single-component molecular conductors [Pt(dmdt)$_2$] and [Ni(dmdt)$_2$] using first-principles calculations. We show that [Ni(dmdt)$_2$] is a Dirac nodal line system with highly one-dimensional edge states at the (001) edge, similar to [Pt(dmdt)$_2$], as demonstrated in prior st...More

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