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Journal of the Physical Society of Japan

Ground State of Antiferromagnetic Quantum Spin Systems on the Triangular Lattice

Takehiko Oguchi, Hidetoshi Nishimori, Y‐h. Taguchi

Published Jan 15, 1986• 79 citations

Abstract

The spin-1/2 antiferromagnetic Heisenberg and X Y models are investigated on the triangular lattice by numerically diagonalizing finite size systems (up to 21 spins). The ground state energies of both models are found to be close to other theoretical predictions except those of Marland and Betts who performed similar analysis to ours. We have numerically constructed a resonating valence bond state of Anderson. It has a relatively large projection on the ground state of the finite Heisenberg model, although the absolute value of the projection decreases linearly with the system size. The trial function proposed by Miyashita for the X Y model does not have an appreciable projection on the numerically exact state. We present evidence for the absence of a sublattice long range order in the Heisenberg model and the existence of the same quantity in the X Y model.

DOI: 10.1143/jpsj.55.323

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The spin-1/2 antiferromagnetic Heisenberg and X Y models are investigated on the triangular lattice by numerically diagonalizing finite size systems (up to 21 spins). The ground state energies of both models are found to be close to other theoretical predictions except those of Marland and Betts who performed similar analysis to ours. We have numerically constructed a resonating valence bond state of Anderson. It has a relatively large projection on the ground state of the finite Heisenberg model, although the absolute value of the projection decreases linearly with the system size. The trial function proposed by Miyashita for the X Y model does not have an appreciable projection on the numerically exact state. We present evidence for the absence of a sublattice long range order in the Heisenberg model and the existence of the same quantity in the X Y model.

We consider a resonating-valence-bond state as a trial wave function for the ground state of the antiferromagnetic Heisenberg model on the square lattice. The energy and the staggered spin-spin correlation functions are calculated on a small lattice and are compared with the results of the exact diagonalization of Oitmaa and Betts. The trial energy is only about 4.7% different from the exact ground-state energy on a 4\ifmmode\times\else\texttimes\fi{}4 lattice. The importance of the singlet pairs between the next-nearest antiferromagnetic sites is inferred. An argument against the previous interpretation of the numerical data as being evidence of long-range order is presented.

The ground states of the antiferromagnetic Heisenberg model on the triangular and square lattices are discussed with use of the combinatorial method on the basis of Anderson's RVB (resonating-valence-bond) variational wave-function. Some properties of RVB states are studied systematically for finite system-size N up to 20 and are compared to the exact values. For the triangular lattice the estimated energy value E RVB =-2.08 is closer to the exact value than that of the spin-wave theory. The value E RVB =-2.36 is estimated for the square lattice. For the square lattice our RVB state is closer to the exact ground state than the Néel state is in the sense of a wave-function. The dimer problem has a close relation to RVB states and is used to count exactly the number of singlet-pair configurations.

'Resonating-valence-bond' (RVB) variational wavefunctions are numerically investigated in order to describe the ground state and the singlet low-lying excited states of the spin-1/2, J 1 -J 2 Heisenberg antiferromagnet with 1/8<or approximately=J 2 /J 1 <or approximately=1 on triangular lattices of N=4p sites compatible with the classical Neel orders. Comparison with previous exact diagonalization results indicates that the singlet eigenstates associated with collinear Neel order, among which the ground state is found, can be accurately described with appropriate superpositions of two-sublattice RVB trial states, while the other singlet low-lying eigenstates associated with four-sublattice Neel order can be well approximated from the four-sublattice RVB trial states.

We study, on the basis of the general entangled-plaquette variational ansatz, the ground-state (GS) properties of the spin- antiferromagnetic Heisenberg model on the triangular lattice. Our numerical estimates are in good agreement with available exact results and comparable, for large system sizes, to those computed via the best alternative numerical approaches, or by means of variational schemes based on specific (i.e. incorporating problem-dependent terms) trial wave functions (WFs). The extrapolation to the thermodynamic limit of our results for lattices comprising up to N =324 spins yields an upper bound of the GS energy per site (in units of the exchange coupling) of − 0.5458(2) [−0.4074(1) for the XX model], while the estimated infinite-lattice order parameter is 0.3178(5) (i.e. ∼64% of the classical value).