Theory of Neutral-Ionic Transition in Organic Crystals.II.Effect of the Intersite Coulomb Interaction
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概要
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The effects of the Coulomb interaction V (Madelung energy) between nearestneighbor sites on the neutral-ionic (Nl) transition are studied. The transition becomesdiscontinuous due to this collective interaction. The degree of charge transfer p,charge transfer gap E.., magnetic gap E... and imaginary-time current-current cor-relation function (which is related to the charge transfer absorption spectrum) arecalculated by the quantum Monte Carlo simulation. From these results, we propose anew kind of elementary excitation -neutral-Tonic domain wall (NIDW) -discussingthe breakdown of the conventional exciton picture near the transition point.
- 社団法人日本物理学会の論文
- 1986-08-15
著者
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TAKIMOTO Jun-ichi
Institute for Molecular Science
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Nagaosa Naoto
Institute For Solid State Physics University Of Tokyo
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Takimoto Jun-ichi
Institute for Molecular Science,Nishigonaka
関連論文
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- Theory of Neutral-lonic Transition in Organic Crystals.I.Monte Carlo Simulation of Modified Hubbard Model
- Theory of Neutral-Ionic Transition in Organic Crystals.IV. Phenomenological Viewpoint
- Theory of Neutral-Ionic Transition in Organic Crystals.II.Effect of the Intersite Coulomb Interaction
- Theory of Neutral-Ionic Transition in Organic Crystals.III.Effect of the Electron-Lattice Interaction
- Competition between Electron-Electron and Electron-Lattice Interactions : Four-Site-Four-Electron Model