Parity law of the singlet-triplet gap in graphitic ribbons

This work explores the possibility to transfer the parity law of the singlet-triplet gap established for square ladders (gapped for even number of legs, gapless for odd number of legs) to fused polyacenic 1-D systems, i.e., graphite ribbons. Qualitative arguments are presented in favor of a gapped c...

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Veröffentlicht in:The European physical journal. B, Condensed matter physics Condensed matter physics, 2006-06, Vol.51 (4), p.517-522
Hauptverfasser: AL HAJJ, M, ALET, F, CAPPONI, S, LEPETIT, M. B, MALRIEU, J.-P, TODO, S
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Sprache:eng
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Zusammenfassung:This work explores the possibility to transfer the parity law of the singlet-triplet gap established for square ladders (gapped for even number of legs, gapless for odd number of legs) to fused polyacenic 1-D systems, i.e., graphite ribbons. Qualitative arguments are presented in favor of a gapped character when the number $n_{\omega}$ of benzene rings along the ribbon width is odd. A series of numerical calculations (quantitative mapping on spin $1/2$ chains, renormalized excitonic treatments and Quantum Monte Carlo) confirm the parity law and the gapless character of the ribbon for even $n_{\omega}$.
ISSN:1434-6028
1434-6036
DOI:10.1140/epjb/e2006-00259-9