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Phys. Rev. B 60, R12553–R12556 (1999)

Electron spin resonance of defects in the Haldane system Y2BaNiO5

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C. D. Batista, K. Hallberg, and A. A. Aligia
Centro Atómico Bariloche and Instituto Balseiro, Comisión Nacional de Energía Atómica, 8400 San Carlos de Bariloche, Argentina

Received 23 March 1999; revised 30 August 1999; published in the issue dated 1 November 1999

We calculate the electron paramagnetic resonance (EPR) spectra of the antiferromagnetic spin-1 chain compound Y2BaNi1-xMgxO5 for different values of x and temperature T much lower than the Haldane gap (100 K). The low-energy spectrum of an anisotropic Heisenberg Hamiltonian, with all parameters determined from experiment, has been solved using the density-matrix renormalization-group method. The observed EPR spectra are quantitatively reproduced by this model. The presence of end-chain S=1/2 states is clearly observed as the main peak in the spectrum and the remaining structure is completely understood.

© 1999 The American Physical Society

URL:
http://link.aps.org/doi/10.1103/PhysRevB.60.R12553
DOI:
10.1103/PhysRevB.60.R12553
PACS:
75.10.Jm, 75.40.Cx, 75.40.Mg