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Journal of Physics and Chemistry of Solids

First-order spin-Peierls transition in S=1 antiferromagnetic Heisenberg chains

Hiroaki Onishi, Seiji Miyashita

Published Jun 1, 2002• 3 citations
Publisher
DOI
10.1016/s0022-3697(02)00089-6

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We investigate a one-dimensional S=1S=1S=1 antiferromagnetic Heisenberg model coupled to a lattice distortion by a quantum Monte Carlo method. Investigating the ground-state energy of the static bond-alternating chain, we find that the instability to a dimerized chain depends on the value of the spin-phonon coupling, unlike the case of S=12.S=\frac{1}{2}.S=21​. The spin state is the dimer state or the uniform Haldane state depending on whether the lattice distorts or not, respectively. At an intermediate value of the spin-phonon coupling, we find the first-order transition between the two states. We also find the coexistence of the two states.