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Phys. Rev. B 76, 075105 (2007) [6 pages]

Photoinduced melting of charge order in a quarter-filled electron system coupled with different types of phonons

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Kenji Yonemitsu1,2,* and Nobuya Maeshima1,3
1Institute for Molecular Science, Okazaki 444-8585, Japan
2Department of Functional Molecular Science, Graduate University for Advanced Studies, Okazaki 444-8585, Japan
3Department of Chemistry, Tohoku University, Aramaki, Aoba-ku, Sendai 980-8578, Japan

Received 2 April 2007; accepted 6 June 2007; published 8 August 2007

Photoinduced melting of charge order is calculated by using the exact many-electron wave function coupled with classically treated phonons in the one-dimensional quarter-filled Hubbard model with Peierls and Holstein types of electron-phonon couplings. The model parameters are taken from recent experiments on (EDO-TTF)2PF6 (EDO-TTF=ethylenedioxy–tetrathiafulvalene) with a (0110) charge order, where transfer integrals are modulated by molecular displacements (bond-coupled phonons) and site energies by molecular deformations (charge-coupled phonons). The charge-transfer photoexcitation from (0110) to (0200) configurations and that from (0110) to (1010) configurations have different energies. The corresponding excited states have different shapes of adiabatic potentials as a function of these two phonon amplitudes. The adiabatic potentials are shown to be useful in understanding differences in the photoinduced charge dynamics and the efficiency of melting, which depend not only on the excitation energy but also on the relative phonon frequency of the bond- and charge-coupled phonons.

© 2007 The American Physical Society

URL:
http://link.aps.org/doi/10.1103/PhysRevB.76.075105
DOI:
10.1103/PhysRevB.76.075105
PACS:
78.20.Bh, 63.20.Kr, 71.10.Fd, 71.45.Lr

*kxy@ims.ac.jp